COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551819
Chemical Name: (4aR)-8-acetyl-5,7-dihydroxy-3,4a,6-trimethyl-1-(4-nitrophenyl)-1,4a-dihydro-4H-[1]benzofuro[3,2-f]indazol-4-one
Smiles: Cc1nn(c2c1C(=O)[C@]1(C(=C2)Oc2c1c(O)c(c(c2C(=O)C)O)C)C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 461.43
Empirical Formula: C24H19N3O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.363
Rotatable bonds: 3
H-donors: 2
H-acceptors: 7
PSA: 147
Number of rings: 5

     

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