In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 17 | Yes |
Popular Name: 6-[(3-aminophenyl)methylamino]-2H-1,2,4-triazine-3,5-dione 6-[(3-aminophenyl)methylamino]-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) | -0.78 | -1.08 | -6.76 | 5 | 7 | 0 | 117 | 233.231 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.32 | -2.75 | -37.56 | 4 | 7 | -1 | 120 | 232.223 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.