In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 23 | Yes |
Popular Name: (3S)-1-ethyl-3-[[2-furylmethyl(2-thienylmethyl)amino]methyl]piperidin-3-ol (3S)-1-ethyl-3-[[2-furylmethyl(2…
None
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) | 2.53 | 9.07 | -92.73 | 3 | 4 | 2 | 42 | 336.501 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 7.46 | -33.65 | 2 | 4 | 1 | 41 | 335.493 | 7 | ↓ |