In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 27 | Yes |
Popular Name: (3S)-N-butyl-N-methyl-1-[2-(p-tolyl)pyrimidin-4-yl]piperidine-3-carboxamide (3S)-N-butyl-N-methyl-1-[2-(p-to…
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) | 4.36 | 11.28 | -16 | 0 | 5 | 0 | 49 | 366.509 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.36 | 11.63 | -40.65 | 1 | 5 | 1 | 51 | 367.517 | 6 | ↓ |