COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527499
Chemical Name: (2'S,3S,3'S,10b'R)-2'-(1,3-benzodioxol-5-ylcarbonyl)-3'-[(3-bromo-4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc4c(c1)OCO4)C(=O)Nc1c2cccc1)cccc3

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Molecular Weight: 649.5
Empirical Formula: C35H25BrN2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.093
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 94
Number of rings: 8

     

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