COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550425
Chemical Name: (4bR,7aS,8R)-8-[(4-methoxyphenyl)carbonyl]-6-(4-nitrophenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 446.42
Empirical Formula: C23H18N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.304
Rotatable bonds: 0
H-donors: 0
H-acceptors: 6
PSA: 125
Number of rings: 5

     

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