| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 22 | Yes |
Popular Name: [4-[(2S)-3-ethoxy-2-hydroxy-propyl]piperazin-1-yl]-(2-ethylthiazol-5-yl)methanone [4-[(2S)-3-ethoxy-2-hydroxy-prop…
| 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) | 0.44 | 1.19 | -11.54 | 1 | 6 | 0 | 66 | 327.45 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.44 | 3.36 | -51.36 | 2 | 6 | 1 | 67 | 328.458 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
