In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: (2R)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-1-(1-piperidyl)propan-1-one (2R)-2-[(3,5-dimethyl-1H-pyrazol…
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) | 0.84 | 4.76 | -45.11 | 3 | 5 | 1 | 66 | 265.381 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 3.56 | -11.46 | 2 | 5 | 0 | 61 | 264.373 | 4 | ↓ |