| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 27 | No |
Popular Name: Isovalerylshikonin Isovalerylshikonin
Find On: PubMed — Wikipedia — Google
CAS Number: 52387-14-1
| 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) | 4.17 | 1.64 | -10.51 | 2 | 6 | 0 | 100 | 372.417 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 107 | TCI |
No pre-computed analogs available. Try a structural similarity search.