| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (1S)-N-(2-methoxyethyl)-N-methyl-1-(3-methyl-2-thienyl)ethane-1,2-diamine (1S)-N-(2-methoxyethyl)-N-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) | 0.99 | 2.12 | -45.01 | 3 | 3 | 1 | 40 | 229.369 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 1.68 | -2.9 | 2 | 3 | 0 | 38 | 228.361 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 3.48 | -27.52 | 3 | 3 | 1 | 40 | 229.369 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 4.14 | -108.62 | 4 | 3 | 2 | 41 | 230.377 | 6 | ↓ |
