In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 21 | Yes |
Popular Name: 4-(aminomethyl)-N-[(1R,2R)-2-(trifluoromethyl)cyclohexyl]benzamide 4-(aminomethyl)-N-[(1R,2R)-2-(tr…
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) | 3.01 | 5.79 | -55.15 | 4 | 3 | 1 | 57 | 301.332 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.01 | 5.38 | -9.34 | 3 | 3 | 0 | 55 | 300.324 | 4 | ↓ |