In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 36 | No |
Popular Name: 3,3-di(cyclodecyl)-2-[(1S,6R,10S)-11-oxabicyclo[8.1.0]undecan-6-yl]prop-2-enoic 3,3-di(cyclodecyl)-2-[(1S,6R,10S…
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) | 9.44 | 18.35 | -47.88 | 0 | 3 | -1 | 53 | 499.8 | 4 | ↓ |
Lo Low (pH 4.5-6) | 9.44 | 16.42 | -4.77 | 1 | 3 | 0 | 50 | 500.808 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.