| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | Yes |
Popular Name: (2S)-N2-[[2-(diethylamino)thiazol-5-yl]methyl]-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-[[2-(diethylamino)thiazo…
| 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) | 2.76 | 8.44 | -36.08 | 2 | 4 | 1 | 33 | 299.508 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 6.8 | -4.59 | 1 | 4 | 0 | 31 | 298.5 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 2.76 | 8.89 | -75.22 | 3 | 4 | 2 | 34 | 300.516 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 2.76 | 9.61 | -111.5 | 3 | 4 | 2 | 37 | 300.516 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 2.76 | 10.08 | -187.8 | 4 | 4 | 3 | 38 | 301.524 | 10 | ↓ |
