In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | No |
Popular Name: 2-[cyclopropyl(2,2,2-trifluoroethyl)amino]-1-(3,4-dihydroxyphenyl)ethanone 2-[cyclopropyl(2,2,2-trifluoroet…
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) | 1.81 | 2.05 | -12.7 | 2 | 4 | 0 | 61 | 289.253 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.81 | 2.98 | -46.25 | 1 | 4 | -1 | 64 | 288.245 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.81 | 3.94 | -45.67 | 3 | 4 | 1 | 62 | 290.261 | 6 | ↓ |