| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 15 | No |
Popular Name: Thiobutabarbital sodium salt Thiobutabarbital sodium salt
Find On: PubMed — Wikipedia — Google
CAS Number: 947-08-0
| 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) | 1.88 | 1.23 | -33.98 | 1 | 4 | -1 | 65 | 227.309 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 2.06 | -34.34 | 1 | 4 | -1 | 65 | 227.309 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 3.12 | -5.64 | 2 | 4 | 0 | 58 | 228.317 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.