COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK119939
Chemical Name: N-[4-(4-benzyl-5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]-2,4-dichlorobenzamide
Smiles: O=C(NC1CCCCC1)CSc1nnc(n1Cc1ccccc1)c1ccc(cc1)NC(=O)c1ccc(cc1Cl)Cl

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Molecular Weight: 594.56
Empirical Formula: C30H29Cl2N5O2S

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 7.043
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 5

     

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