In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: 3-(aminomethyl)-5,6-dihydro-1H-benzo[h]quinolin-2-one 3-(aminomethyl)-5,6-dihydro-1H-b…
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) | 1.49 | 4.02 | -44.25 | 4 | 3 | 1 | 61 | 227.287 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.49 | 3.62 | -9.5 | 3 | 3 | 0 | 59 | 226.279 | 1 | ↓ |