In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 16 | Yes |
Popular Name: N-methyl-1-(4-methyl-4-piperidyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]methanamine N-methyl-1-(4-methyl-4-piperidyl…
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) | 1.17 | 5.53 | -91.02 | 3 | 3 | 2 | 30 | 228.38 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.17 | 3.94 | -37.78 | 2 | 3 | 1 | 29 | 227.372 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.