In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1R)-N-ethyl-N'-[(4-fluorophenyl)methyl]-N'-methyl-1-phenyl-ethane-1,2-diamine (1R)-N-ethyl-N'-[(4-fluorophenyl…
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) | 3.65 | 9.1 | -37.8 | 2 | 2 | 1 | 20 | 287.402 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.65 | 8.23 | -3.03 | 1 | 2 | 0 | 15 | 286.394 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.65 | 11.05 | -130.66 | 3 | 2 | 2 | 21 | 288.41 | 7 | ↓ |