COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK539769
Chemical Name: (6aS,6bR,9aS,10R)-10-[(4-bromophenyl)carbonyl]-8-(4-butoxyphenyl)-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)c1ccc(cc1)Br

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Molecular Weight: 571.47
Empirical Formula: C31H27BrN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.866
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 66
Number of rings: 6

     

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