COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112821
Chemical Name: methyl4-{(3aS,4R,9bR)-8-[(4-methoxyphenyl)sulfamoyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl}benzoate
Smiles: COc1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1ccc(cc1)C(=O)OC

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Molecular Weight: 490.58
Empirical Formula: C27H26N2O5S

Physical State: Dry powder
Available Amount: 83 mg

Lipinsky:
logP: 4.72
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 102
Number of rings: 5

     

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