In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (1S,2R)-N-[(2-ethoxyphenyl)methyl]-2-(trifluoromethyl)cyclohexanamine (1S,2R)-N-[(2-ethoxyphenyl)methy…
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) | 4.58 | 9.29 | -31.36 | 2 | 2 | 1 | 26 | 302.36 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.58 | 8.72 | -3.82 | 1 | 2 | 0 | 21 | 301.352 | 6 | ↓ |