COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807052
Chemical Name: 3-[(4-nitrobenzyl)sulfanyl]-4-phenyl-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-4H-1,2,4-triazole
Smiles: [O-][N+](=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)C12CC3CC(C2)CC(C1)C3

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Molecular Weight: 446.57
Empirical Formula: C25H26N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.254
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 7

     

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