COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK577263
Chemical Name: (8S,8aR,11aS)-N-(1,3-benzodioxol-5-yl)-10-(4-methoxyphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: COc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)Nc2ccc3c(c2)OCO3)C=Cc2c1cccc2

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Molecular Weight: 509.52
Empirical Formula: C29H23N3O6

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.575
Rotatable bonds: 0
H-donors: 1
H-acceptors: 6
PSA: 97
Number of rings: 7

     

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