In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: 2-[(1R)-1-[[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]ethyl]phenol 2-[(1R)-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) | 1.87 | 5.35 | -41.04 | 3 | 4 | 1 | 55 | 272.372 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 5.51 | -103.88 | 4 | 4 | 2 | 56 | 273.38 | 3 | ↓ |