| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: (2S)-N-[[2-(2-pyridyl)thiazol-4-yl]methyl]octan-2-amine (2S)-N-[[2-(2-pyridyl)thiazol-4-…
| 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) | 4.72 | 8.71 | -38.4 | 2 | 3 | 1 | 42 | 304.483 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.72 | 7.51 | -8.35 | 1 | 3 | 0 | 38 | 303.475 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
