COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK554987
Chemical Name: (4aR,4bS,7aR,8S)-8-[(3,4-dimethoxyphenyl)carbonyl]-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)NC2=O

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Molecular Weight: 355.35
Empirical Formula: C18H17N3O5

Physical State: Dry powder
Available Amount: 287 mg

Lipinsky:
logP: 0.482
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 4

     

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