In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 17 | Yes |
Popular Name: N'-[(3-chloro-4-fluoro-phenyl)methyl]-N,N-diethyl-ethane-1,2-diamine N'-[(3-chloro-4-fluoro-phenyl)me…
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) | 3.05 | 6.36 | -48.2 | 2 | 2 | 1 | 20 | 259.776 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 8.47 | -125.32 | 3 | 2 | 2 | 21 | 260.784 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 7.1 | -36.95 | 2 | 2 | 1 | 16 | 259.776 | 7 | ↓ |