| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 18 | Yes |
Popular Name: 4-chloro-2-[[[(1S)-1-(4-methylthiazol-2-yl)ethyl]amino]methyl]phenol 4-chloro-2-[[[(1S)-1-(4-methylth…
| 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) | 2.93 | 3.01 | -6.37 | 2 | 3 | 0 | 45 | 282.796 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 3.77 | -38.74 | 1 | 3 | -1 | 48 | 281.788 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.93 | 4.26 | -41.01 | 3 | 3 | 1 | 50 | 283.804 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
