COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK082581
Chemical Name: 2-{[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2Z)-3-(2-nitrophenyl)prop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)N/N=C/C=C\c1ccccc1[N+](=O)[O-]

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Molecular Weight: 525.03
Empirical Formula: C25H25ClN6O3S

Physical State: Dry powder
Available Amount: 408 mg

Lipinsky:
logP: 7.502
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 143
Number of rings: 4

     

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