In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 30 | Yes |
Popular Name: 1-[5-(2-naphthyl)-4-oxo-3H-pyrido[2,3-d]pyrimidin-2-yl]piperidine-4-carboxamide 1-[5-(2-naphthyl)-4-oxo-3H-pyrid…
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) | 3.46 | 9.54 | -21.28 | 3 | 7 | 0 | 105 | 399.454 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 8.03 | -57.53 | 2 | 7 | -1 | 108 | 398.446 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.