In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 19 | Yes |
Popular Name: (2S)-N-[(2-methylpyrazol-3-yl)methyl]-1-propyl-piperidine-2-carboxamide (2S)-N-[(2-methylpyrazol-3-yl)me…
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) | 1.31 | 5.59 | -37.06 | 2 | 5 | 1 | 51 | 265.381 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 3.5 | -8.28 | 1 | 5 | 0 | 50 | 264.373 | 5 | ↓ |