In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 20 | Yes |
Popular Name: N-methyl-1-[2-[(2S)-2-methyl-1-piperidyl]-3-quinolyl]methanamine N-methyl-1-[2-[(2S)-2-methyl-1-p…
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) | 3.11 | 8.43 | -46.94 | 2 | 3 | 1 | 33 | 270.4 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.11 | 6.96 | -5.98 | 1 | 3 | 0 | 28 | 269.392 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 8.89 | -94.5 | 3 | 3 | 2 | 34 | 271.408 | 3 | ↓ |