COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK105465
Chemical Name: 5-(4-chlorophenyl)-4-[(2-nitrobenzylidene)amino]-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)c1nnc(n1/N=C\c1ccccc1[N+](=O)[O-])S

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Molecular Weight: 359.8
Empirical Formula: C15H10ClN5O2S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 5.696
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 127
Number of rings: 3

     

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