In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2011 | 22 | Yes |
Popular Name: 6-[(4-ethylthiazol-2-yl)methyl]-2,5-dioxo-1H-1,6-naphthyridine-3-carbonitrile 6-[(4-ethylthiazol-2-yl)methyl]-…
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) | 1.42 | 3.36 | -47.17 | 0 | 6 | -1 | 95 | 311.346 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 5.34 | -20 | 1 | 6 | 0 | 92 | 312.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.