In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2010 | 16 | Yes |
Popular Name: N-methyl-1-[(3S)-1-(6-methylpyridazin-3-yl)-3-piperidyl]methanamine N-methyl-1-[(3S)-1-(6-methylpyri…
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) | 1.24 | 5.66 | -52.06 | 2 | 4 | 1 | 46 | 221.328 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.24 | 5.77 | -84.12 | 3 | 4 | 2 | 47 | 222.336 | 3 | ↓ |