In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 18 | Yes |
Popular Name: 2-methyl-N-[[(3S)-1-pyrimidin-4-yl-3-piperidyl]methyl]propan-1-amine 2-methyl-N-[[(3S)-1-pyrimidin-4-…
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) | 1.57 | 8.32 | -40.2 | 2 | 4 | 1 | 46 | 249.382 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.57 | 8.83 | -84.69 | 3 | 4 | 2 | 47 | 250.39 | 5 | ↓ |