COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807758
Chemical Name: 2-(3-{[4-(4-methoxyphenyl)-5-(pyridin-3-yl)-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)nnc1c1cccnc1

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Molecular Weight: 521.6
Empirical Formula: C29H23N5O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.388
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 115
Number of rings: 6

     

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