Your Partner to Escape Velocity

We at BioSolveIT aim to transform how researchers approach virtual drug discovery. For more than two decades, we craft the most user-friendly drug discovery products infused with scientifically excellent ingredients.
Our software is designed and developed to help you succeed with your projects in the most interactive and efficient way.

Drug Discovery Revolution


Lead the field

Work with precision at unrivaled speed to make informed decisions backed up by science. To meet the challenges of modern drug discovery, take advantage of BioSolveIT’s detailed and precise results — without compromise. We will address every step of your needs, from start to finish.

Discover with confidence

Profit from our long-standing experience and collaboration history with Fortune 100 pharma companies and academia. Our secure software has been developed and backed by renowned partners - including BAYER, Roche, Merck, BASF, and others. BioSolveIT’s success record is cited in thousands of publications worldwide.
start right away

Start right away

BioSolveIT’s technology is fine-tuned for the needs of the pharma industry, academics, beginners, and veterans alike. Clean and comprehensive user interface removes the need for a learning curve. Easy access fostered by intuitive operation will maximize the likelihood of your success. Simply download the multiplatform software and discover active molecules!
drug discovery evolution

Experience drug discovery

Evolve the way you approach drug design, with the most liberating breakthrough. The stimulating interface creates a dialog between you and your compound where you can see why something is considered good or bad. Clean visualization combined with scientific finesse mold into a fun-to-use drug design experience.

Drug Discovery Revolution

Want Us to Find Actives for You?

As your contract research partner, BioSolveIT can support your in your drug discovery challenges. Our team of experts in medicinal and computational chemistry with decades of experience deploy our proprietary solutions across the whole drug discovery process to help you achieve your goals.
  • Chemical Space Docking — Screen billion-sized Chemical Spaces for the most promising and accessible drug candidates
  • Set-up of your own Chemical Space — Exploit all possibilities of your in-house chemistry
  • Scaffold hopping — Access novel molecular intellectual property
  • And many more ...

Current news

AMBrosia by Ambinter — Divine Access to Billions of Compounds
February 16, 2024 16:51 CET
Experience the divine flavor of almost infinite drug-like compounds with the new Chemical Space AMBrosia. This ultra-large compound molecule collection has been created in close collaboration with Ambinter (a brand of Greenpharma). It is based on unique in-house building blocks and chemical reactions, leading to a stunning amount of 110,496,278,572...
Read on
EST Timezone Workshop: Kinase Ligand Design
Thu, 29 Feb 2024, 19:00 CET (Berlin)
Due to widespread popularity and numerous requests for a live demonstration tailored to the American continent, we are excited to announce the re-iteration of the successful BioSolveIT workshop on kinase ligand design. Kinases stand out as a popular focus in drug development. Their popularity is evident from the numerous FDA...
Read on
European Workshop in Drug Design 2024 in Siena: Meet the BioSolvers
February 15, 2024 13:27 CET
The European Workshop in Drug Design 2024 takes places in the beautiful City of Siena. The event takes places from May 19-23 2024 in Certosa di Pontignano (Siena, Italy). The 14th workshop of the series promises a breathtaking panorama of the city of Siena from a monastery complex situated in...
Read on