In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 21 | Yes |
Popular Name: (3R)-3-hydroxy-3-[(2-hydroxyethylamino)methyl]-1-phenethyl-piperidin-2-one (3R)-3-hydroxy-3-[(2-hydroxyethy…
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) | 0.10 | 1.93 | -39.91 | 4 | 5 | 1 | 77 | 293.387 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.10 | 0.65 | -9.23 | 3 | 5 | 0 | 73 | 292.379 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.