In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (3R)-3-amino-4-[4-(dimethylaminomethyl)-1-piperidyl]-4-oxo-butanamide (3R)-3-amino-4-[4-(dimethylamino…
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) | -0.44 | 0.5 | -91 | 6 | 6 | 2 | 95 | 258.366 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.44 | 0.2 | -49.09 | 5 | 6 | 1 | 94 | 257.358 | 5 | ↓ |