In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 18 | Yes |
Popular Name: 1-(4-ethyl-4-piperidyl)-N-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]methanamine 1-(4-ethyl-4-piperidyl)-N-methyl…
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) | 2.01 | 7.17 | -103.11 | 3 | 3 | 2 | 30 | 256.434 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 5.43 | -37.8 | 2 | 3 | 1 | 29 | 255.426 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.