In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 18 | Yes |
Popular Name: 1-(4-ethyl-4-piperidyl)-N-methyl-N-[(2-methylthiazol-4-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) | 1.41 | 6.82 | -105.47 | 3 | 3 | 2 | 34 | 269.458 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 5.21 | -40.2 | 2 | 3 | 1 | 33 | 268.45 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.