In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 20 | Yes |
Popular Name: N-[(4-fluorophenyl)methyl]-N-phenethyl-ethane-1,2-diamine N-[(4-fluorophenyl)methyl]-N-phe…
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) | 2.51 | 6.85 | -52.9 | 3 | 2 | 1 | 31 | 273.375 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 8.55 | -43.04 | 3 | 2 | 1 | 30 | 273.375 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.51 | 9.04 | -138.64 | 4 | 2 | 2 | 32 | 274.383 | 7 | ↓ |