In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: (1R)-N-(1H-pyrazol-4-ylmethyl)-1-(2-pyridyl)ethanamine (1R)-N-(1H-pyrazol-4-ylmethyl)-1…
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) | 0.59 | 3.72 | -39.18 | 3 | 4 | 1 | 58 | 203.269 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.59 | 2.5 | -8.15 | 2 | 4 | 0 | 54 | 202.261 | 4 | ↓ |