Glycoside
GD004988
Name:
NoneFormula:
C11H13O5N4BrSmiles:
Nc1n[nH]c(=O)c2c1c(Br)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1n[nH]c(=O)c2[nH]cc(Br)c12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 2 |
| MolWt: | 361.15 | Num_heavy_atoms: | 21 |
| TPSA: | 146.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD04279
Formula: C6H5ON4Br
Smiles:
Nc1n[nH]c(=O)c2[nH]cc(Br)c12| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 0 |
| MolWt: | 229.04 | Num_heavy_atoms: | 12 |
| TPSA: | 87.56 | NumAromaticRings: | 2 |
