In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (1R,2S)-N-[(2,6-dichlorophenyl)methyl]-2-(trifluoromethyl)cyclohexanamine (1R,2S)-N-[(2,6-dichlorophenyl)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) | 5.45 | 9.71 | -28.82 | 2 | 1 | 1 | 17 | 327.197 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.45 | 8.86 | -2.95 | 1 | 1 | 0 | 12 | 326.189 | 4 | ↓ |