In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 20 | Yes |
Popular Name: (1R)-1-(2,4-dichlorophenyl)-N-[[1-(difluoromethyl)imidazol-2-yl]methyl]ethanamine (1R)-1-(2,4-dichlorophenyl)-N-[[…
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) | 3.46 | 8.31 | -40.17 | 2 | 3 | 1 | 34 | 321.178 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 7.7 | -34.95 | 2 | 3 | 1 | 31 | 321.178 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 7.35 | -6.12 | 1 | 3 | 0 | 30 | 320.17 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.46 | 8.69 | -117.5 | 3 | 3 | 2 | 36 | 322.186 | 5 | ↓ |