COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK231074
Chemical Name: 2-{[5-(1,3-benzodioxol-5-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,3-dihydro-1H-indol-1-yl)ethanone
Smiles: C=CCn1c(SCC(=O)N2CCc3c2cccc3)nnc1c1ccc2c(c1)OCO2

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Molecular Weight: 420.49
Empirical Formula: C22H20N4O3S

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 4.793
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 5

     

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