COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK548765
Chemical Name: 4-(phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)-8-(1,3-benzodioxol-5-yl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc2c(c1)OCO2)Oc1ccc(cc1)C(=O)c1ccccc1

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Molecular Weight: 584.58
Empirical Formula: C35H24N2O7

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 4.672
Rotatable bonds: 1
H-donors: 0
H-acceptors: 7
PSA: 102
Number of rings: 8

     

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