COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK554813
Chemical Name: (4aR,4bS,7aR,8S)-8-[(3,4-dimethoxyphenyl)carbonyl]-6-(4-methylphenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: COc1cc(ccc1OC)C(=O)[C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C

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Molecular Weight: 445.47
Empirical Formula: C25H23N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.116
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 88
Number of rings: 5

     

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