COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543969
Chemical Name: (8S,8aR,11aS)-N-(4-chlorophenyl)-10-(2,3-dihydro-1,4-benzodioxin-6-yl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3

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Molecular Weight: 527.96
Empirical Formula: C29H22ClN3O5

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 5.087
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 88
Number of rings: 7

     

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