Glycoside

GD057192
Name:
NoneFormula:
C13H14O5N5ClSmiles:
O[C@H]1O[C@H](Cn2cc(-c3ncc(Cl)cn3)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cn1cc(-c2ncc(Cl)cn2)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.5 |
AlogP: | -1.81 | Num_rotatable_bonds: | 3 |
MolWt: | 343.73 | Num_heavy_atoms: | 23 |
TPSA: | 146.64 | NumAromaticRings: | 2 |
Unique Aglycone
AD28696
Formula: C8H6N5Cl
Smiles:
Cn1cc(-c2ncc(Cl)cn2)nn1HBA: | 5 | RingCount: | 2 |
HBD: | 0 | FractionCSP3: | 0.14 |
AlogP: | 0.93 | Num_rotatable_bonds: | 1 |
MolWt: | 195.61 | Num_heavy_atoms: | 13 |
TPSA: | 56.49 | NumAromaticRings: | 2 |