COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551026
Chemical Name: (4bR,7aS,8R)-6-(2-methyl-4-nitrophenyl)-8-(phenylcarbonyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1ccc(cc1C)[N+](=O)[O-])C1N([C@H]2C(=O)c2ccccc2)N=CC=C1

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Molecular Weight: 430.42
Empirical Formula: C23H18N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.689
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 115
Number of rings: 5

     

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