COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK104331
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/C(=C/c2ccccc2)/Cl)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 560.12
Empirical Formula: C30H30ClN5O2S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 9.075
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 106
Number of rings: 4

     

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