COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK218384
Chemical Name: 2-bromo-N-[1-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Smiles: O=C(NC1CCCCC1)CSc1nnc(n1C)C(NC(=O)c1ccccc1Br)C

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Molecular Weight: 480.43
Empirical Formula: C20H26BrN5O2S

Physical State: Dry powder
Available Amount: 227 mg

Lipinsky:
logP: 3.088
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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