UCSF

ZINC22704118

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 35 No

Popular Name: (4S)-3-hydroxy-4-[5-(3-nitrophenyl)-2-furyl]-2-phenyl-6,7,8,9-tetrahydro-4H-pyrazolo[3,4-b]quinolin- (4S)-3-hydroxy-4-[5-(3-nitrophen…

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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) 4.66 12.45 -72.41 1 9 -1 129 467.461 4 ↓
Lo Low (pH 4.5-6) 4.66 11.65 -23.35 2 9 0 126 468.469 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.