In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2005 | 30 | Yes |
Popular Name: COCc1cccc(c1)C[C@@H](/C=C/[C@H]2[C@@H](CC(=O)[C@@H]2CCCCCCC(=O)O)O)O COCc1cccc(c1)C[C@@H](/C=C/[C@H]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) | 2.64 | -2.9 | -54.32 | 2 | 6 | -1 | 106 | 417.522 | 13 | ↓ |