In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 20th, 2008 | 22 | Yes |
Popular Name: 1-[2-[[3-(hydroxymethyl)phenyl]amino]-2-oxo-ethyl]cycloheptane-1-carboxylic 1-[2-[[3-(hydroxymethyl)phenyl]a…
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) | 2.44 | 5.74 | -64.45 | 2 | 5 | -1 | 89 | 304.366 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.44 | 3.8 | -15.82 | 3 | 5 | 0 | 87 | 305.374 | 5 | ↓ |