COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL233230
Chemical Name: methyl2-{8-[(2,4-dichlorophenyl)carbonyl]-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl}benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C1N(C2C(=O)c2ccc(cc2Cl)Cl)C=Cc2c1cccc2

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Molecular Weight: 547.39
Empirical Formula: C29H20Cl2N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.991
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 83
Number of rings: 6

     

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