In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2005 | 28 | Yes |
Popular Name: CCO[C@@H]1COC[C@H]1Oc2cc(ccc2OC)C(=O)Nc3c(cncc3Cl)Cl CCO[C@@H]1COC[C@H]1Oc2cc(ccc2OC)…
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) | 3.01 | -2.11 | -12.03 | 1 | 7 | 0 | 78 | 427.284 | 7 | ↓ |