In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 18 | Yes |
Popular Name: 3-[(1R)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]ethyl]phenol 3-[(1R)-1-[(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) | 1.70 | 3.51 | -45.6 | 4 | 4 | 1 | 66 | 246.334 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 2.4 | -7.06 | 3 | 4 | 0 | 61 | 245.326 | 4 | ↓ |