In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 16 | Yes |
Popular Name: 4-[4-(ethylaminomethyl)-3,5-dimethyl-pyrazol-1-yl]butan-1-ol 4-[4-(ethylaminomethyl)-3,5-dime…
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) | 0.60 | 3.1 | -42.84 | 3 | 4 | 1 | 55 | 226.344 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.60 | 1.73 | -6.86 | 2 | 4 | 0 | 50 | 225.336 | 7 | ↓ |