COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK599454
Chemical Name: methyl2-[(8S,8aR,11aS)-8-(furan-2-ylcarbonyl)-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]-4,5-dimethylthiophene-3-carboxylate
Smiles: COC(=O)c1c(sc(c1C)C)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1ccco1

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Molecular Weight: 502.55
Empirical Formula: C27H22N2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.283
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 125
Number of rings: 6

     

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