In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 16 | Yes |
Popular Name: 6-[(1-ethylpyrazol-4-yl)amino]-2H-1,2,4-triazine-3,5-dione 6-[(1-ethylpyrazol-4-yl)amino]-2…
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) | -0.34 | -0.21 | -9.86 | 3 | 8 | 0 | 108 | 222.208 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.11 | -1.86 | -40.34 | 2 | 8 | -1 | 112 | 221.2 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.