COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL386944
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[4-(difluoromethyl)-2,3-dimethyl-6-oxo-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanamide
Smiles: N#Cc1c(NC(=O)CCn2c(=O)cc(c3c2nn(c3C)C)C(F)F)sc2c1CCCC2

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Molecular Weight: 445.49
Empirical Formula: C21H21F2N5O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.544
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 119
Number of rings: 4

     

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