In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 18 | Yes |
Popular Name: (1S)-1-(1-ethylpyrazol-4-yl)-N-[(1-methyl-4-piperidyl)methyl]ethanamine (1S)-1-(1-ethylpyrazol-4-yl)-N-[…
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) | 1.61 | 7.6 | -98.53 | 3 | 4 | 2 | 39 | 252.406 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 6.53 | -35.46 | 2 | 4 | 1 | 34 | 251.398 | 5 | ↓ |