In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 20 | Yes |
Popular Name: 5-[(1-methyltriazol-4-yl)methylamino]-2,3-dihydrophthalazine-1,4-dione 5-[(1-methyltriazol-4-yl)methyla…
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) | 0.45 | -1.8 | -53.16 | 2 | 8 | -1 | 112 | 271.26 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.45 | -2.53 | -16.99 | 3 | 8 | 0 | 109 | 272.268 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.