In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 24 | No |
Popular Name: (4aR)-7-isopropyl-5,8-dimethoxy-1,4a-dimethyl-3,4,9,10-tetrahydrophenanthren-2-one (4aR)-7-isopropyl-5,8-dimethoxy-…
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) | 4.61 | 9.94 | -6.98 | 0 | 3 | 0 | 36 | 328.452 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0676196A1; US5654343 | IBM Patent Data |