| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2011 | 20 | No |
Popular Name: XANTHINOLNICOTINATE XANTHINOLNICOTINATE
Find On: PubMed — Wikipedia — Google
CAS Number: 437-74-1
| 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) | -0.37 | 4.6 | -43.21 | 1 | 9 | -1 | 126 | 272.2 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.82 | 6.03 | -18.56 | 2 | 9 | 0 | 123 | 273.208 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.