In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: 4-[(1S)-1-[(1-isopropyl-3,5-dimethyl-pyrazol-4-yl)amino]ethyl]benzene-1,3-diol 4-[(1S)-1-[(1-isopropyl-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) | 2.75 | 2.87 | -9.63 | 3 | 5 | 0 | 70 | 289.379 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 3 | -29.02 | 4 | 5 | 1 | 72 | 290.387 | 4 | ↓ |