COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444006
Chemical Name: 2-({5-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(CSc1nnc(n1c1ccccc1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)NCc1cccnc1

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Molecular Weight: 548.63
Empirical Formula: C30H24N6O3S

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 3.41
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 135
Number of rings: 6

     

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