| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 13 | Yes |
Popular Name: 3-[[(1S)-1-(5-bromo-2-thienyl)ethyl]amino]propanenitrile 3-[[(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) | 2.35 | 6.12 | -53.84 | 2 | 2 | 1 | 40 | 260.18 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 4.9 | -6.66 | 1 | 2 | 0 | 36 | 259.172 | 4 | ↓ |
