Aglycone
AD42088
Formula: C13H18O2N2Br
Smiles:
O=C(NCCO)C1C[NH2+]CC1c1ccc(Br)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 314.2 | Num_heavy_atoms: | 18 |
| TPSA: | 65.94 | NumAromaticRings: | 1 |