COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330808
Chemical Name: 1-[(3aS,4R,9bR)-4-(6-bromo-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]ethanone
Smiles: CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1cc2OCOc2cc1Br

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Molecular Weight: 412.28
Empirical Formula: C21H18BrNO3

Available Amount: 0 mg

Lipinsky:
logP: 4.37
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 5

     

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