| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-1-(4-bromo-2-thienyl)-N1,N1-bis(2-methoxyethyl)propane-1,2-diamine (1S,2S)-1-(4-bromo-2-thienyl)-N1…
| 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) | 1.74 | 1.73 | -46.54 | 3 | 4 | 1 | 49 | 352.318 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 1.42 | -4.78 | 2 | 4 | 0 | 48 | 351.31 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.74 | 4.5 | -107.81 | 4 | 4 | 2 | 51 | 353.326 | 9 | ↓ |
