In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: 6-[(1S)-1-amino-2-(2-chlorophenyl)ethyl]-3,4-dihydro-1H-quinolin-2-one 6-[(1S)-1-amino-2-(2-chloropheny…
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) | 1.53 | 6.53 | -55.67 | 4 | 3 | 1 | 57 | 301.797 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 6.22 | -8.61 | 3 | 3 | 0 | 55 | 300.789 | 3 | ↓ |