| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 17 | Yes |
Popular Name: (2S)-N1-isobutyl-N2-methyl-N2-(thiazol-4-ylmethyl)butane-1,2-diamine (2S)-N1-isobutyl-N2-methyl-N2-(t…
| 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) | 2.33 | 6.99 | -118.51 | 3 | 3 | 2 | 34 | 257.447 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 4.09 | -2.85 | 1 | 3 | 0 | 28 | 255.431 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 5.31 | -39.64 | 2 | 3 | 1 | 33 | 256.439 | 8 | ↓ |
