Company lists · Data refreshed October 2026

Top 25 Chemical property prediction companies based in the United States

RevenueBase identified 113 company matches for chemical property prediction companies associated with the United States as of October 2026 and tracks 4,846 professional contacts across them, including 2,751 with verified work emails. New York is the largest hub.

This list covers company matches for chemical property prediction companies associated with the United States, found by RevenueBase SmartSearch using the meaning of business descriptions in its company graph at Exact. Ranked by professionals tracked, largest first. Rows show recorded descriptions where available, Exact search membership and the snapshot date. Data refreshed October 9, 2026.

Published by RevenueBase, a B2B data infrastructure company. This list was built with RevenueBase SmartSearch, the natural-language company search RevenueBase customers use to build their own targeted lists and unlock verified emails and direct dials at the companies on them. How these lists are built and judged.

How to read this list RevenueBase SmartSearch · Exact Recorded Oct 9, 2026 How this list was built
113Companies
4,846Contacts tracked
2,751Verified emails
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The 25 largest chemical property prediction companies based in the United States

Ranked by team size
Top 25 of 113 company matches for chemical property prediction companies based in the United States, ordered by professional contacts tracked in RevenueBase, largest first. Recorded Oct 9, 2026. The RevenueBase SmartSearch column shows Exact match membership in this saved search. Click a contact count to view that company's people. Totals use company locations recorded by RevenueBase; the displayed preview is a smaller selection.
#CompanyRevenueBase SmartSearchHeadquartersEmployeesContacts
1Exact matchRadnor, PA, United StatesHQ recorded Oct 9, 20261,001-5,0001,190 contacts →

Exact match

“Certara accelerates medicines using proprietary biosimulation software, technology and services to transform traditional drug discovery and development.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
2Exact matchNew York, NY, United StatesHQ recorded Oct 9, 2026501-1,000966 contacts →

Exact match

“Schrödinger’s industry-leading computational platform facilitates the research efforts of biopharmaceutical and industrial companies, academic institutions, and government…”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
3Exact matchBoston, MA, United StatesHQ recorded Oct 9, 2026501-1,000455 contacts →

Exact match

“Dotmatics is the global leader in R&D scientific software that connects science, data, and decision-making.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
4Exact matchDurham, NC, United StatesHQ recorded Oct 9, 2026201-500194 contacts →

Exact match

“Simulations Plus is a leading provider of modeling and simulation software and consulting services supporting drug discovery, development research, and regulatory submissions.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
5Exact matchBay, CA, United StatesHQ recorded Oct 9, 202651-200191 contacts →

Exact match

“Meet Albert, the partner for the scientist of the future.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
6Exact matchNew York, NY, United StatesHQ recorded Oct 9, 202651-200167 contacts →

Exact match

“D.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
7Exact matchGilroy, CA, United StatesHQ recorded Oct 9, 202651-200130 contacts →

Exact match

“At Aganitha, we make AI work for Science.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
8Exact matchSanta Fe, NM, United StatesHQ recorded Oct 9, 202651-200112 contacts →

Exact match

“OpenEye, Cadence Molecular Sciences is an industry leader in computational molecular design based on decades of delivering rapid, robust, and scalable software, toolkits, and…”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
9Exact matchBoston, MA, United StatesHQ recorded Oct 9, 202651-20097 contacts →

Exact match

“Metrum Research Group, established in 2004, is a global leader in biomedical modeling and simulation.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
10Exact matchBurlingame, CA, United StatesHQ recorded Oct 9, 202651-20092 contacts →

Exact match

“Collaborative Drug Discovery's CDD VAULT is a hosted biological and chemical database that securely manages your private and external data.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
11Exact matchParsippany, NJ, United StatesHQ recorded Oct 9, 202651-20088 contacts →

Exact match

“For more than fifty years, OLI has helped engineers predict and solve the world’s toughest chemistry problems.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
12Exact matchSan Diego, CA, United StatesHQ recorded Oct 9, 202651-20070 contacts →

Exact match

“eMolecules is the leading online platform to buy specialty chemistry and hard-to-find molecules.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
13Exact matchSuite 203, United StatesHQ recorded Oct 9, 202651-20040 contacts →

Exact match

“Scilligence is a leading innovator of cross-platform, mobile cheminformatics and bioinformatics software solutions.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
14Exact matchBrooklyn, United StatesHQ recorded Oct 9, 202611-5036 contacts →

Exact match

“Overview: AccutarBio employs artificial intelligence to revolutionize drug discovery.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
15Exact matchResearch Triangle Park, NC, United StatesHQ recorded Oct 9, 202611-5022 contacts →

Exact match

“Sciome LLC is an innovative research and technology consulting company providing state of the art informatics solutions for the life sciences industry.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
16Exact matchCambridge, MA, United StatesHQ recorded Oct 9, 202611-5020 contacts →

Exact match

“MetaCell is a life science-focused software company composed of scientists and software engineers with deep domain expertise in computational neuroscience, molecular biology, data…”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
17Exact matchHillsborough, NJ, United StatesHQ recorded Oct 9, 202611-5020 contacts →

Exact match

“DeltaSoft has been providing scientific software and expert services for research companies since 1996.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
18Exact matchLos Angeles, CA, United StatesHQ recorded Oct 9, 20261-1017 contacts →

Exact match

“Pythialabs is an innovative technology start-up based in Los Angeles that aims to develop cutting-edge solutions for the biotechnology industry.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
19Exact matchSan Marcos, TX, United StatesHQ recorded Oct 9, 20261-1014 contacts →

Exact match

“Sunthetics offers an easy-to-use machine-learning platform that enables up to 32x faster development of new medicine, materials, chemical processes and formulations.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
20Exact matchDoylestown, PA, United StatesHQ recorded Oct 9, 20261-1014 contacts →

Exact match

“The mission of Conifer Point is to be the premier provider of web-based, drug design tools so that researchers can access rigorous molecular modeling in user friendly format.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
21Exact matchSan Francisco, CA, United StatesHQ recorded Oct 9, 20261-1012 contacts →

Exact match

“Syntensor is building software that converts large biological datasets into decisions.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
22Exact matchBoston, United StatesHQ recorded Oct 9, 20261-1012 contacts →

Exact match

“Building biology with AI.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
23Exact matchSan Diego, CA, United StatesHQ recorded Oct 9, 202651-20012 contacts →

Exact match

“InSilicoMinds specializes in providing AI and advanced modeling and simulation solutions for Pharma & Life Sciences.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
24Exact matchNewtown, PA, United StatesHQ recorded Oct 9, 20261-1010 contacts →

Exact match

“Novatia, LLC is a Pennsylvania-based company that provides scientific solutions for the pharmaceutical, biotechnology, and chemical industries.”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase
25Exact matchCleveland, OH, United StatesHQ recorded Oct 9, 202611-5010 contacts →

Exact match

“We are proud to be a leading provider of AI-based software, expert systems, and in silico consulting for regulatory agencies, academia, and the chemical and pharmaceutical…”

Recorded in the RevenueBase company graph · Oct 9, 2026 · View company records in RevenueBase

Showing 25 of 113 chemical property prediction companies based in the United States

See the full list, filter by size, metro and specialty, and access 2,751 tracked professional contacts with verified work emails. Direct dials are available where recorded.

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Chemical property prediction companies based in the United States at a glance

As of Oct 9, 2026
56.8%Verified-email coverage
42.9Average contacts per company
1-10Median size (employees)
8.8%Largest-city concentration · New York
Oct 9, 2026Page data refreshed

Companies by employee count

1-10
69
11-50
23
51-200
16
201-500
1
501-1,000
2
1,001-5,000
1
5,001-10,000
1

Email recency for this list is measured worldwide rather than for United States, so it is reported there. Company counts and contact totals on this page are exact for United States, over 113 companies.

How this list was built

The recorded descriptions help you assess these company matches. Check a company’s website for its current services and locations.

Source
The RevenueBase company graph: 60 million companies and 398.9 million professional contacts resolved from primary sources, queried with RevenueBase SmartSearch, the natural-language company search available to every RevenueBase user.
What qualifies
Company records associated with the United States whose business descriptions match “chemical property prediction companies” by meaning at the Exact setting. Descriptions are compiled in the RevenueBase company graph from public websites, profiles and company information where available; they are not guaranteed quotations from the company's website.
RevenueBase SmartSearch
Describe a niche company in your own words to find businesses by meaning. Exact, Similar, Related and Broad control the breadth of RevenueBase SmartSearch. This saved list uses Exact. Each row's Exact match badge shows inclusion in that search, not an individual score or a service-quality judgment.
Public preview
The public preview omits records without a verified work email. Where headquarters information is recorded, preview rows are also filtered to this page’s location. Dataset totals and geographic summaries describe the full matched records before these preview filters.
Match quality
RevenueBase's August 25, 2026 study assessed 4,198 description/company pairs across matching settings. The publisher reports 86% good or better at Exact. This evaluates the method across queries; it does not audit this individual list. Recorded company descriptions, where available, help you judge each match yourself. Read the full methodology: how the lists are built and what the study measures.
Ranking
Team size, largest first: companies are ordered by the number of professionals RevenueBase tracks at each one. Employee ranges shown are reported bands, for context.
Verification
Every displayed company carries at least one verified work email. RevenueBase tracks 2,751 professional contacts with verified work emails across the full matched dataset. Contacts re-verify on a rolling cadence, and each contact's own verification date is shown inside RevenueBase.
Refresh
This page's figures were pulled from the company graph on October 9, 2026. Lists refresh periodically as the graph is re-checked.
Record context
Company records and descriptions can change. Check the company's website for its current services and locations.

Frequently asked

What is RevenueBase SmartSearch?

RevenueBase SmartSearch finds niche companies by the meaning of their business descriptions in the RevenueBase company graph. Exact, Similar, Related and Broad control how closely companies must fit your description. This list uses Exact for “chemical property prediction companies”; each Exact match badge shows search membership, not an individual similarity or quality score.

How many chemical property prediction companies are there based in the United States?

RevenueBase identified 113 company matches for chemical property prediction companies associated with the United States as of October 2026, using the meaning of business descriptions at Exact. This is the recorded matched set in the RevenueBase company graph.

What is the largest company on this list?

Certara tops the displayed preview by professional contacts tracked in RevenueBase. Recorded headquarters appear in the company rows.

Which city has the most chemical property prediction companies?

New York leads with 10 company records, followed by San Diego (9) and San Francisco (7).

How do I get contact information for these companies?

A free RevenueBase account lets you run this exact search and work limited free results with 500 credits to start. Upgrading provides access to the 2,751 professional contacts with verified work emails tracked across these 113 companies; direct dials are available where recorded.

How current is this list?

The list refreshes periodically as the company graph is re-checked. This page's figures were pulled on October 9, 2026.

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About this data

RevenueBase is a B2B data infrastructure company. Its company graph covers 60 million companies and 398.9 million professional contacts, with emails verified on a rolling cadence rather than scraped once and left to decay. These company lists are generated directly from that graph with RevenueBase SmartSearch, the same natural-language company search every RevenueBase user has: describe a market in plain words, get the companies that match, and add verified emails and direct dials for the people at them. It is the same data that powers RevenueBase's B2B data products, and a free account includes 500 credits to start. How these lists are built and judged.