In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | Yes |
Popular Name: (1S)-N,N-diethyl-N'-[(4-fluorophenyl)methyl]-1-(p-tolyl)ethane-1,2-diamine (1S)-N,N-diethyl-N'-[(4-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) | 4.47 | 11.16 | -36.74 | 2 | 2 | 1 | 16 | 315.456 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.47 | 12.52 | -127.46 | 3 | 2 | 2 | 21 | 316.464 | 8 | ↓ |