In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 17 | Yes |
Popular Name: (2S)-N-[(1R,2R,4R)-2,4-dimethylcyclohexyl]piperidine-2-carboxamide (2S)-N-[(1R,2R,4R)-2,4-dimethylc…
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) | 2.25 | 5.88 | -35.43 | 3 | 3 | 1 | 46 | 239.383 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.25 | 4.55 | -7 | 2 | 3 | 0 | 41 | 238.375 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.