| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 18 | Yes |
Popular Name: N'-[(1S)-1-(5-bromo-2-thienyl)ethyl]-N,N-diisopropyl-ethane-1,2-diamine N'-[(1S)-1-(5-bromo-2-thienyl)et…
| 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) | 4.26 | 7.7 | -31.88 | 2 | 2 | 1 | 16 | 334.347 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.26 | 5.78 | -1.27 | 1 | 2 | 0 | 15 | 333.339 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.26 | 6.84 | -39.94 | 2 | 2 | 1 | 20 | 334.347 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.26 | 8.9 | -112.22 | 3 | 2 | 2 | 21 | 335.355 | 7 | ↓ |
