COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807747
Chemical Name: 2-(3-{[5-(3-chloro-1-benzothiophen-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: COc1ccc(cc1)n1c(SCCCn2c(=O)c3cccc4c3c(c2=O)ccc4)nnc1c1sc2c(c1Cl)cccc2

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Molecular Weight: 611.14
Empirical Formula: C32H23ClN4O3S2

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 8.722
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 130
Number of rings: 7

     

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