In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 17 | Yes |
Popular Name: N-[(2,5-difluorophenyl)methyl]-N-ethyl-N',N'-dimethyl-ethane-1,2-diamine N-[(2,5-difluorophenyl)methyl]-N…
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) | 2.40 | 6.93 | -33.57 | 1 | 2 | 1 | 8 | 243.321 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.40 | 4.57 | -2.68 | 0 | 2 | 0 | 6 | 242.313 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 7.21 | -35.41 | 1 | 2 | 1 | 8 | 243.321 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.40 | 9.19 | -105.09 | 2 | 2 | 2 | 9 | 244.329 | 6 | ↓ |