UCSF

ZINC36360907

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 29 Yes

Popular Name: (4R)-3-methyl-4-(4-oxochromen-3-yl)-1-(6-oxo-1H-pyridazin-3-yl)-5,7-dihydro-4H-pyrazolo[3,4-b]pyridi (4R)-3-methyl-4-(4-oxochromen-3-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.94 2.42 -71.84 1 9 -1 129 388.363 2 ↓
Ref Reference (pH 7) 1.75 5.87 -71.39 1 9 -1 126 388.363 2 ↓
Lo Low (pH 4.5-6) 1.48 4.31 -23.55 2 9 0 126 389.371 2 ↓
Lo Low (pH 4.5-6) 1.30 7.7 -26.49 2 9 0 123 389.371 2 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )