COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL393103
Chemical Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitro-1H-pyrazole-3-carboxamide
Smiles: N#Cc1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1n[nH]cc1[N+](=O)[O-]

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Molecular Weight: 373.44
Empirical Formula: C17H19N5O3S

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 4.715
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 155
Number of rings: 3

     

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