| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 16 | Yes |
Popular Name: (2S)-3-ethyl-N2-methyl-N2-(thiazol-4-ylmethyl)pentane-1,2-diamine (2S)-3-ethyl-N2-methyl-N2-(thiaz…
| 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) | 1.83 | 3.77 | -42.31 | 3 | 3 | 1 | 44 | 242.412 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 5.09 | -28.71 | 3 | 3 | 1 | 43 | 242.412 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.83 | 4.4 | -125.06 | 4 | 3 | 2 | 45 | 243.42 | 7 | ↓ |
