COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311409
Chemical Name: (3aR,7aS)-2-{1-[3-(1H-pyrrol-1-yl)phenyl]ethyl}hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1[C@@H]2CCCC[C@@H]2C(=O)N1C(c1cccc(c1)n1cccc1)C

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Molecular Weight: 322.41
Empirical Formula: C20H22N2O2

Physical State: Dry powder
Available Amount: 19 mg

Lipinsky:
logP: 3.582
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 4

     

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