COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807734
Chemical Name: 2-(3-{[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: Clc1ccc(cc1)c1nnc([nH]1)SCCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 448.93
Empirical Formula: C23H17ClN4O2S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.001
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 104
Number of rings: 5

     

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