COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042841
Chemical Name: 8-[(3-bromo-4-methoxyphenyl)carbonyl]-10-(2,3-dihydro-1,4-benzodioxin-6-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1Br)C(=O)C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3

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Molecular Weight: 587.43
Empirical Formula: C30H23BrN2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.343
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 85
Number of rings: 7

     

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