In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 24 | Yes |
Popular Name: 2-piperidinecarboxamide, N-[(4-butoxy-3-methoxyphenyl)methyl]-6-methyl- 2-piperidinecarboxamide, N-[(4-b…
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) | 2.91 | 7.12 | -38.79 | 3 | 5 | 1 | 64 | 335.468 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 5.8 | -9.06 | 2 | 5 | 0 | 60 | 334.46 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.