In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2005 | 30 | No |
Popular Name: CC1(CC2=C(C(=O)C1)C(=C[C@H]3N2CCc4c3cc(c(c4)OC)OC)NCC(=O)O)C CC1(CC2=C(C(=O)C1)C(=C[C@H]3N2CC…
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 | 7.62 | -81.77 | 0 | 7 | -1 | 91 | 411.478 | 4 | ↓ |