COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK354669
Chemical Name: 4-({[(isoquinolin-1-ylsulfanyl)acetyl]amino}methyl)benzoicacid
Smiles: O=C(CSc1nccc2c1cccc2)NCc1ccc(cc1)C(=O)O

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Molecular Weight: 352.41
Empirical Formula: C19H16N2O3S

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 2.905
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 104
Number of rings: 3

     

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