In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 14 | Yes |
Popular Name: N-(azetidin-3-yl)-1-ethyl-N-methyl-piperidin-4-amine N-(azetidin-3-yl)-1-ethyl-N-meth…
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) | 0.77 | 1.39 | -32.58 | 2 | 3 | 1 | 20 | 198.334 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 1.34 | -32.64 | 2 | 3 | 1 | 20 | 198.334 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 3.01 | -84.05 | 3 | 3 | 2 | 24 | 199.342 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.77 | 3.64 | -95.67 | 3 | 3 | 2 | 21 | 199.342 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.