In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2008 | 21 | Yes |
Popular Name: 1-[4-[(3-pyridylmethylamino)methyl]phenyl]pyrrolidin-2-one 1-[4-[(3-pyridylmethylamino)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) | 1.02 | 7.62 | -54.2 | 2 | 4 | 1 | 50 | 282.367 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.02 | 7.9 | -114.44 | 3 | 4 | 2 | 51 | 283.375 | 5 | ↓ |