COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL347104
Chemical Name: ethyl4-[9,11-dioxo-8-(thiophen-2-ylcarbonyl)-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C(N1C2c2ccccc2C=C1)C(=O)c1cccs1

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Molecular Weight: 498.56
Empirical Formula: C28H22N2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.988
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 112
Number of rings: 6

     

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