In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 17 | Yes |
Popular Name: N-[(2,4-difluorophenyl)methyl]-1-(3-methyl-1H-pyrazol-4-yl)methanamine N-[(2,4-difluorophenyl)methyl]-1…
None
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) | 1.68 | 5.38 | -48.78 | 3 | 3 | 1 | 45 | 238.261 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 5.41 | -48.59 | 3 | 3 | 1 | 45 | 238.261 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 4 | -7.88 | 2 | 3 | 0 | 41 | 237.253 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 4.03 | -8.38 | 2 | 3 | 0 | 41 | 237.253 | 4 | ↓ |