COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050681
Chemical Name: 10-(1,3-benzodioxol-5-ylmethyl)-N-(5-chloro-2-methoxyphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: COc1ccc(cc1NC(=O)C1C2C(=O)N(C(=O)C2C2N1C=Cc1c2cccc1)Cc1ccc2c(c1)OCO2)Cl

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Molecular Weight: 557.99
Empirical Formula: C30H24ClN3O6

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 5.865
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 97
Number of rings: 7

     

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