In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 17 | Yes |
Popular Name: (2S)-2-(3,4-dihydro-2H-quinolin-1-ylmethyl)cyclopentanone (2S)-2-(3,4-dihydro-2H-quinolin-…
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) | 3.00 | 8.68 | -6.25 | 0 | 2 | 0 | 20 | 229.323 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 8.56 | -35.36 | 1 | 2 | 1 | 22 | 230.331 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.