COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK063984
Chemical Name: 2-{[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-(3,4-dimethoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1cc(ccc1OC)/C(=N\NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)/C

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Molecular Weight: 528.07
Empirical Formula: C26H30ClN5O3S

Physical State: Dry powder
Available Amount: 407 mg

Lipinsky:
logP: 7.078
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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