COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK101377
Chemical Name: 4-[(2-chloro-5-nitrobenzylidene)amino]-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)c1nnc(n1/N=C\c1cc(ccc1Cl)[N+](=O)[O-])S

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Molecular Weight: 389.82
Empirical Formula: C16H12ClN5O3S

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 5.654
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 136
Number of rings: 3

     

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