In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2005 | 28 | Yes |
Popular Name: CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)c3ccc(cc3)Cl)c4nc(no4)c5ccc(cc5)Br CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2…
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) | 6.11 | -0.67 | -41.85 | 1 | 4 | 1 | 43 | 459.795 | 3 | ↓ |