| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 23 | Yes |
Popular Name: 2-(benzotriazol-1-yl)-1-[4-[(2S)-2-hydroxybutyl]piperazin-1-yl]ethanone 2-(benzotriazol-1-yl)-1-[4-[(2S)…
| 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) | 0.83 | 2.03 | -18.72 | 1 | 7 | 0 | 74 | 317.393 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | 4.3 | -57.66 | 2 | 7 | 1 | 76 | 318.401 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
