Glycoside

GD014694
Name:
NoneFormula:
C16H16O4N5ISmiles:
Nc1nc(OCc2ccc(I)cc2)c2ncn(C3CC(O)C(O)O3)c2n1Aglycone:
Nc1nc2c(c(OCc3ccc(I)cc3)n1)N=C[N]2Sugarmoiety:
OC1CC(O)C(O)O1Other Identifiers
Properties
HBA: | 9 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.31 |
AlogP: | 1.19 | Num_rotatable_bonds: | 4 |
MolWt: | 469.24 | Num_heavy_atoms: | 26 |
TPSA: | 128.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD10418
Formula: C12H9ON5I
Smiles:
Nc1nc2c(c(OCc3ccc(I)cc3)n1)N=C[N]2HBA: | 6 | RingCount: | 3 |
HBD: | 2 | FractionCSP3: | 0.08 |
AlogP: | 2.15 | Num_rotatable_bonds: | 3 |
MolWt: | 366.14 | Num_heavy_atoms: | 19 |
TPSA: | 87.49 | NumAromaticRings: | 2 |