COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042835
Chemical Name: 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-])c1n[nH]c(c1)c1ccccc1

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Molecular Weight: 425.86
Empirical Formula: C18H12ClN7O2S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 5.294
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 156
Number of rings: 4

     

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