Aglycone
AD43697
Formula: C13H14O4NBr
Smiles:
COc1cc(Br)cc2c1OCC(C(=O)NCCO)=C2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.16 | Num_heavy_atoms: | 19 |
| TPSA: | 67.79 | NumAromaticRings: | 1 |