| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 25 | Yes |
Popular Name: [4-[(2S)-2-hydroxy-3,3-dimethyl-butyl]piperazin-1-yl]-(1-methylindol-4-yl)methanone [4-[(2S)-2-hydroxy-3,3-dimethyl-…
| 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) | 2.10 | 5.98 | -12.87 | 1 | 5 | 0 | 49 | 343.471 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.10 | 8.17 | -45.99 | 2 | 5 | 1 | 50 | 344.479 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
