| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2004 | 29 | Yes |
Popular Name: 2-[(5-benzyl-8-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]ethyl-diethyl-ammonium 2-[(5-benzyl-8-methyl-[1,2,4]tri…
| 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) | 5.31 | 14.63 | -39.64 | 1 | 5 | 1 | 48 | 406.579 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.31 | 12.46 | -11.22 | 0 | 5 | 0 | 47 | 405.571 | 8 | ↓ |
