COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK762832
Chemical Name: methyl2-[2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)pyridin-1(4H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCCC2)N1C(=CC(C(=C1N)C#N)(C(F)(F)F)C(F)(F)F)C

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Molecular Weight: 479.45
Empirical Formula: C20H19F6N3O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.644
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 107
Number of rings: 3

     

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