COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK090515
Chemical Name: 4-[({[4-(4-bromophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)Br)c1ccncc1

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Molecular Weight: 509.39
Empirical Formula: C22H17BrN6O2S

Physical State: Dry powder
Available Amount: 409 mg

Lipinsky:
logP: 4.498
Rotatable bonds: 3
H-donors: 3
H-acceptors: 2
PSA: 141
Number of rings: 4

     

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