Glycoside
GD100912
Name:
NoneFormula:
C21H26O6N5FSmiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Nc1cc(F)cc(C(=O)N2CCCCC2)c1Aglycone:
NC(=O)C1=C(Nc2cc(F)cc(C(=O)N3CCCCC3)c2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.48 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 463.47 | Num_heavy_atoms: | 33 |
| TPSA: | 163.17 | NumAromaticRings: | 2 |
Unique Aglycone
AD42640
Formula: C16H17O2N5F
Smiles:
NC(=O)C1=C(Nc2cc(F)cc(C(=O)N3CCCCC3)c2)[N]C=N1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 330.34 | Num_heavy_atoms: | 24 |
| TPSA: | 101.89 | NumAromaticRings: | 1 |
