| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 21 | Yes |
Popular Name: N-(2-methoxyethyl)-N-methyl-N'-[(4-phenyl-2-thienyl)methyl]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) | 3.13 | 7.58 | -35.83 | 2 | 3 | 1 | 26 | 305.467 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 5.17 | -5.11 | 1 | 3 | 0 | 24 | 304.459 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 6.54 | -42.67 | 2 | 3 | 1 | 29 | 305.467 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.13 | 8.95 | -118.37 | 3 | 3 | 2 | 30 | 306.475 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
