In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2005 | 22 | No |
Popular Name: C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@@H]3[C@@H]1[C@H]4CC[C@H]([C@]4(CC3)C)CO C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@@H…
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) | 3.86 | -0.55 | -8.06 | 1 | 2 | 0 | 37 | 302.458 | 1 | ↓ |