COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK246538
Chemical Name: 2-methyl-1-{5-[(3-nitrobenzyl)amino]-3-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}propan-1-one
Smiles: CC(C(=O)n1nc(nc1NCc1cccc(c1)[N+](=O)[O-])c1cccs1)C

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Molecular Weight: 371.42
Empirical Formula: C17H17N5O3S

Physical State: Dry powder
Available Amount: 222 mg

Lipinsky:
logP: 3.258
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 133
Number of rings: 3

     

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