COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK261118
Chemical Name: 3,4-dichloro-N-[2-(5-{[2-(4-cyanophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Smiles: N#Cc1ccc(cc1)C(=O)CSc1nnc(n1C)CCNC(=O)c1ccc(c(c1)Cl)Cl

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Molecular Weight: 474.37
Empirical Formula: C21H17Cl2N5O2S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 4.145
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 125
Number of rings: 3

     

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