COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK462398
Chemical Name: 2-(1,3-benzodioxol-5-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)quinoline-4-carboxamide
Smiles: N#Cc1c(sc2c1CCCCC2)NC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2

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Molecular Weight: 467.55
Empirical Formula: C27H21N3O3S

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 6.568
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 6

     

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