| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(2-methylthiazol-5-yl)methyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(2-methyl…
| 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) | 1.49 | 5.54 | -36.7 | 2 | 3 | 1 | 29 | 242.412 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 3.61 | -3.75 | 1 | 3 | 0 | 28 | 241.404 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.49 | 6.78 | -114.25 | 3 | 3 | 2 | 34 | 243.42 | 7 | ↓ |
