COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL393113
Chemical Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propanamide
Smiles: N#Cc1c(NC(=O)CCn2nc(cc2C)[N+](=O)[O-])sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 415.52
Empirical Formula: C20H25N5O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.412
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 3

     

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