In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2014 | 22 | No |
Popular Name: Pergolide Pergolide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 66104-22-1 , 66104-23-2
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) | 3.84 | 10.48 | -95.02 | 2 | 2 | 2 | 18 | 316.514 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 8.29 | -29.98 | 1 | 2 | 1 | 17 | 315.506 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.