UCSF

ZINC65496382

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 24 No

Popular Name: (5S)-5-(1-methyl-2,3-dihydrobenzotriazol-5-yl)-3,5,6,8-tetrahydropyrazolo[4,3-g]quinolin-7-one (5S)-5-(1-methyl-2,3-dihydrobenz…

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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 3.71 -46.87 4 7 1 92 321.364 1 ↓
Mid Mid (pH 6-8) 1.94 3.65 -97.36 5 7 2 87 322.372 1 ↓
Mid Mid (pH 6-8) 1.94 3.96 -86.83 5 7 2 84 322.372 1 ↓

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

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