In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2005 | 30 | No |
Popular Name: C[C@@]1(CC2=C(/C(=N/CC(=O)O)/C[C@@H]3N2CCc4c3cc(c(c4)OC)OC)C(=O)C1)C C[C@@]1(CC2=C(/C(=N/CC(=O)O)/C[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) | 1.24 | -0.94 | -82.29 | 0 | 7 | -1 | 91 | 411.478 | 4 | ↓ |