In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 20 | Yes |
Popular Name: 3-Allylamino-6-(4-methoxy-benzyl)-4H-[1,2,4]triazin-5-one 3-Allylamino-6-(4-methoxy-benzyl…
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) | 2.22 | 3.74 | -21.66 | 2 | 6 | 0 | 80 | 272.308 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 3.63 | -43.31 | 1 | 6 | -1 | 83 | 271.3 | 6 | ↓ |