| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[[2-(2-pyridyl)thiazol-4-yl]methyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[[2-(2-pyr…
| 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) | 2.55 | 6.53 | -33.03 | 2 | 4 | 1 | 42 | 305.471 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 4.6 | -8.66 | 1 | 4 | 0 | 41 | 304.463 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 7.71 | -108.1 | 3 | 4 | 2 | 47 | 306.479 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 5.69 | -36.69 | 2 | 4 | 1 | 46 | 305.471 | 8 | ↓ |
