In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: 4-methyl-2-[(1S)-1-[[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]ethyl]phenol 4-methyl-2-[(1S)-1-[[(4R)-1-meth…
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) | 2.30 | 5.22 | -42.98 | 3 | 4 | 1 | 55 | 286.399 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.30 | 5.39 | -104.93 | 4 | 4 | 2 | 56 | 287.407 | 3 | ↓ |