Aglycone
AD40645
Formula: C12H13O3N2Br
Smiles:
NC(=O)CN1CC(c2ccc(Br)cc2)OCC1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.15 | Num_heavy_atoms: | 18 |
| TPSA: | 72.63 | NumAromaticRings: | 1 |