In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: 4-[(1S)-1-[[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]ethyl]benzene-1,3-diol 4-[(1S)-1-[[(4R)-1-methyl-4,5,6,…
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) | 1.37 | 1.74 | -44.6 | 4 | 5 | 1 | 75 | 288.371 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.37 | 1.91 | -108.37 | 5 | 5 | 2 | 76 | 289.379 | 3 | ↓ |