In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2005 | 28 | Yes |
Popular Name: c1cc(cc(c1)OCC(=O)O)[C@H]2CCC[C@@H](C2)NC[C@@H](c3cccc(c3)Cl)O c1cc(cc(c1)OCC(=O)O)[C@H]2CCC[C@…
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) | 4.08 | -1.82 | -79.4 | 3 | 5 | 0 | 86 | 403.906 | 8 | ↓ |