In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 30 | Yes |
Popular Name: N-[(3-methoxyphenyl)methyl]-1-[(1S)-1-(1-naphthyl)ethyl]piperidine-4-carboxamide N-[(3-methoxyphenyl)methyl]-1-[(…
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) | 4.77 | 12.15 | -44.55 | 2 | 4 | 1 | 43 | 403.546 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.77 | 10.67 | -9.57 | 1 | 4 | 0 | 42 | 402.538 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.