In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | Yes |
Popular Name: (1R,3S)-N-[(2,5-difluorophenyl)methyl]-3-(trifluoromethyl)cyclohexanamine (1R,3S)-N-[(2,5-difluorophenyl)m…
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) | 4.21 | 8.66 | -44.43 | 2 | 1 | 1 | 17 | 294.287 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 7.46 | -3.4 | 1 | 1 | 0 | 12 | 293.279 | 4 | ↓ |