COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK202159
Chemical Name: 3-[({[5-(1-{[(2-bromophenyl)carbonyl]amino}ethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1cccc(c1)C(=O)O)CSc1nnc(n1C)C(NC(=O)c1ccccc1Br)C

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Molecular Weight: 518.39
Empirical Formula: C21H20BrN5O4S

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 3.398
Rotatable bonds: 8
H-donors: 3
H-acceptors: 4
PSA: 151
Number of rings: 3

     

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