In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 18 | Yes |
Popular Name: (1R)-1-(2,6-difluorophenyl)-N,N-dipropyl-ethane-1,2-diamine (1R)-1-(2,6-difluorophenyl)-N,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) | 2.72 | 5.75 | -40.35 | 3 | 2 | 1 | 31 | 257.348 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 7.03 | -25.01 | 3 | 2 | 1 | 30 | 257.348 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 7.41 | -111.33 | 4 | 2 | 2 | 32 | 258.356 | 7 | ↓ |