In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2005 | 28 | Yes |
Popular Name: C[C@@H]1CC[C@@H]2C[C@H]1c3c(cc4c(c3O)[C@@H]5CC(=CC[C@H]5C(O4)(C)C)C)C2(C)C C[C@@H]1CC[C@@H]2C[C@H]1c3c(cc4c…
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) | 7.77 | 1.55 | -4.76 | 1 | 2 | 0 | 29 | 380.572 | 0 | ↓ |