COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL398945
Chemical Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Smiles: N#Cc1c(NC(=O)c2ccccc2Cn2nc(c(c2C)[N+](=O)[O-])C)sc2c1CCC(C2)C

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Molecular Weight: 449.53
Empirical Formula: C23H23N5O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.476
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 4

     

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