In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2010 | 16 | Yes |
Popular Name: N-butyl-N-[(3-fluorophenyl)methyl]ethane-1,2-diamine N-butyl-N-[(3-fluorophenyl)methy…
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) | 2.12 | 4.63 | -46.15 | 3 | 2 | 1 | 31 | 225.331 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.12 | 6.71 | -125.99 | 4 | 2 | 2 | 32 | 226.339 | 7 | ↓ |