In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 19 | Yes |
Popular Name: 3-(allylamino)-6-(4-methylbenzyl)-1,2,4-triazin-5(4H)-one 3-(allylamino)-6-(4-methylbenzyl…
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) | 3.07 | 4.99 | -43.25 | 1 | 5 | -1 | 74 | 255.301 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 6.47 | -11.86 | 2 | 5 | 0 | 71 | 256.309 | 5 | ↓ |