In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 8th, 2008 | 22 | Yes |
Popular Name: 3-(cyclohexylamino)-6-(p-tolylmethyl)-4H-1,2,4-triazin-5-one 3-(cyclohexylamino)-6-(p-tolylme…
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) | 3.88 | 8.2 | -14.59 | 2 | 5 | 0 | 71 | 298.39 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.33 | 8.12 | -43.39 | 1 | 5 | -1 | 74 | 297.382 | 4 | ↓ |