In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 22 | Yes |
Popular Name: (1R)-N,N-diethyl-N'-[(2-fluorophenyl)methyl]-1-phenyl-ethane-1,2-diamine (1R)-N,N-diethyl-N'-[(2-fluoroph…
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) | 3.98 | 9.69 | -3.18 | 1 | 2 | 0 | 15 | 300.421 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.98 | 10.23 | -28.67 | 2 | 2 | 1 | 16 | 301.429 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.98 | 9.34 | -36.94 | 2 | 2 | 1 | 20 | 301.429 | 8 | ↓ |