| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2014 | 20 | Yes |
Popular Name: Ergoline-8-carboxylic acid methyl ester Ergoline-8-carboxylic acid methy…
Find On: PubMed — Wikipedia — Google
CAS Number: 30341-92-5
| 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) | 2.25 | 5.42 | -15.06 | 1 | 4 | 0 | 51 | 270.332 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 6.62 | -56.56 | 2 | 4 | 1 | 56 | 271.34 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.