| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 7th, 2011 | 19 | No |
Popular Name: N-(2-diethylaminoethyl)-2-methyl-5-oxo-3-sulfanyl-1,2,4-triazine-6-carboxamide N-(2-diethylaminoethyl)-2-methyl…
| 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) | -0.13 | 2.29 | -66.62 | 2 | 7 | 0 | 87 | 285.373 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.13 | 0.19 | -45.63 | 1 | 7 | -1 | 86 | 284.365 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.59 | 4.3 | -48.6 | 3 | 7 | 1 | 84 | 286.381 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
