COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK554022
Chemical Name: (6aS,6bR,9aS,10R)-8-(4-butoxyphenyl)-10-[(3-nitrophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 537.57
Empirical Formula: C31H27N3O6

Physical State: Dry powder
Available Amount: 243 mg

Lipinsky:
logP: 4.926
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 112
Number of rings: 6

     

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