COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL343449
Chemical Name: 10-(1,3-benzodioxol-5-yl)-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)C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1ccc2c(c1)OCO2)cccc3)Cl

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Molecular Weight: 543.96
Empirical Formula: C29H22ClN3O6

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 5.027
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 97
Number of rings: 7

     

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