In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 16 | Yes |
Popular Name: (8R,9S)-9-methyl-9-propyl-1,4,10-trioxaspiro[4.6]undecan-8-ol (8R,9S)-9-methyl-9-propyl-1,4,10…
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) | 1.80 | 2.51 | -4.38 | 1 | 4 | 0 | 48 | 230.304 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4387234 | IBM Patent Data |