In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | Yes |
Popular Name: (1S)-N,N-diethyl-N'-[(2-fluorophenyl)methyl]-1-(p-tolyl)ethane-1,2-diamine (1S)-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) | 4.42 | 8.62 | -3.79 | 1 | 2 | 0 | 15 | 314.448 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 9.97 | -37.08 | 2 | 2 | 1 | 20 | 315.456 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 10.02 | -32.72 | 2 | 2 | 1 | 16 | 315.456 | 8 | ↓ |