COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110823
Chemical Name: N-[(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-3-methylbenzamide
Smiles: CCn1c(SCC(=O)NC2CCCCC2)nnc1CNC(=O)c1cccc(c1)C

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Molecular Weight: 415.56
Empirical Formula: C21H29N5O2S

Physical State: Dry powder
Available Amount: 270 mg

Lipinsky:
logP: 3.383
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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