In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 18 | Yes |
Popular Name: 4-[(1S)-1-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]phenol 4-[(1S)-1-[(1,3,5-trimethylpyraz…
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) | 2.09 | 3.68 | -9.81 | 2 | 4 | 0 | 50 | 245.326 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.09 | 3.78 | -32.25 | 3 | 4 | 1 | 51 | 246.334 | 3 | ↓ |