COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK424054
Chemical Name: 3-chloro-N-methyl-6-nitro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide
Smiles: CN(C(=O)c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])Cc1c(C)nn(c1C)C

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Molecular Weight: 392.87
Empirical Formula: C17H17ClN4O3S

Physical State: Dry powder
Available Amount: 551 mg

Lipinsky:
logP: 4.002
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 112
Number of rings: 3

     

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