COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545961
Chemical Name: (6aS,6bR,9aS,10R)-10-(1H-benzotriazol-1-ylcarbonyl)-8-(2-methoxy-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2)[N+](=O)[O-]

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Molecular Weight: 536.5
Empirical Formula: C28H20N6O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.734
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 143
Number of rings: 7

     

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