UCSF

ZINC22756185

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 37 Yes

Popular Name: 2-[(11-carboxy-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-2-yl)oxy]-7,8,9,10-tetrahydro-6H-cyclohe 2-[(11-carboxy-7,8,9,10-tetrahyd…

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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) 7.06 13.01 -130.33 0 7 -2 115 494.547 4 ↓
Mid Mid (pH 6-8) 7.06 13.37 -125.97 1 7 -1 117 495.555 4 ↓
Lo Low (pH 4.5-6) 7.06 13.74 -128.09 2 7 0 118 496.563 4 ↓

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

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