In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 21 | Yes |
Popular Name: 3-allylamino-6-[(4-ethoxyphenyl)methyl]-4H-1,2,4-triazin-5-one 3-allylamino-6-[(4-ethoxyphenyl)…
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) | 3.06 | 4.54 | -42.27 | 1 | 6 | -1 | 83 | 285.327 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 6.01 | -12.89 | 2 | 6 | 0 | 80 | 286.335 | 7 | ↓ |