In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 18 | Yes |
Popular Name: 1-[(1R,2R)-2-(aminomethyl)cyclohexyl]-N-methyl-piperidine-4-carboxamide 1-[(1R,2R)-2-(aminomethyl)cycloh…
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) | 0.80 | 3.71 | -120.34 | 5 | 4 | 2 | 61 | 255.406 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 1.94 | -50.45 | 4 | 4 | 1 | 60 | 254.398 | 3 | ↓ |