| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 16 | No |
Popular Name: N-(2-methoxyethyl)-N-methyl-N'-(1-oxothian-4-yl)ethane-1,2-diamine N-(2-methoxyethyl)-N-methyl-N'-(…
| 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) | -0.50 | 2.85 | -131.65 | 3 | 4 | 2 | 47 | 250.408 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.50 | -0.78 | -12.44 | 1 | 4 | 0 | 42 | 248.392 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.50 | 1.65 | -44.02 | 2 | 4 | 1 | 43 | 249.4 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.50 | 0.42 | -55.43 | 2 | 4 | 1 | 46 | 249.4 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
