In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: 1-[(2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]propyl]pyrrolidin-2-one 1-[(2S)-2-[(3,5-dimethyl-1H-pyra…
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) | 0.33 | 4.84 | -45.32 | 3 | 5 | 1 | 66 | 251.354 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.33 | 3.72 | -10.77 | 2 | 5 | 0 | 61 | 250.346 | 5 | ↓ |