| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2014 | 22 | No |
Popular Name: Tegaserod maleate Tegaserod maleate
Find On: PubMed — Wikipedia — Google
CAS Number: 189188-57-6
| 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) | 2.78 | 6.76 | -27.55 | 4 | 6 | 1 | 86 | 302.402 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 5.64 | -11.01 | 3 | 6 | 0 | 88 | 301.394 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 6.69 | -9.28 | 3 | 6 | 0 | 83 | 301.394 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 6.92 | -84.74 | 5 | 6 | 2 | 88 | 303.41 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.