COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567682
Chemical Name: 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-])c1[nH]nc2c1CCC2

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Molecular Weight: 389.82
Empirical Formula: C15H12ClN7O2S

Physical State: Dry powder
Available Amount: 256 mg

Lipinsky:
logP: 4.508
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 156
Number of rings: 4

     

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