| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 21 | Yes |
Popular Name: N,N-diethyl-N'-(5-methyl-6-phenyl-1,2,4-triazin-3-yl)ethane-1,2-diamine N,N-diethyl-N'-(5-methyl-6-pheny…
| 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) | 2.55 | 9.31 | -38.26 | 2 | 5 | 1 | 55 | 286.403 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 7.16 | -8.05 | 1 | 5 | 0 | 54 | 285.395 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0077983A1; US4616014 | IBM Patent Data |
