COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK664891
Chemical Name: 2-{[5-(2-chloro-4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-5-nitro-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)benzamide
Smiles: Cc1ccc(c(c1)Cl)c1nnc(n1c1ccccc1)Sc1ccc(cc1C(=O)NC12CC3CC(C2)CC(C1)C3)[N+](=O)[O-]

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Molecular Weight: 600.14
Empirical Formula: C32H30ClN5O3S

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 9.435
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 130
Number of rings: 8

     

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