Glycoside
GD102924
Name:
NoneFormula:
C19H23O6N2BrSmiles:
Cc1cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c2cc(Br)ccc2n1Aglycone:
Cc1cc(C(=O)NCCO)c2cc(Br)ccc2n1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 455.31 | Num_heavy_atoms: | 28 |
| TPSA: | 121.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD43567
Formula: C13H13O2N2Br
Smiles:
Cc1cc(C(=O)NCCO)c2cc(Br)ccc2n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.23 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 3 |
| MolWt: | 309.16 | Num_heavy_atoms: | 18 |
| TPSA: | 62.22 | NumAromaticRings: | 2 |
