In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1S)-N'-[(4-fluorophenyl)methyl]-N,N'-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N'-[(4-fluorophenyl)methyl]…
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) | 3.27 | 8.35 | -41.69 | 2 | 2 | 1 | 20 | 273.375 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.27 | 6.58 | -2.89 | 1 | 2 | 0 | 15 | 272.367 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.27 | 10.24 | -134.32 | 3 | 2 | 2 | 21 | 274.383 | 6 | ↓ |