Aglycone

AD42088
Formula: C13H18O2N2Br
Smiles:
O=C(NCCO)C1C[NH2+]CC1c1ccc(Br)cc1HBA: | 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 |
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 |