Glycoside

GD102477
Name:
NoneFormula:
C18H19O4N6SBrSmiles:
OC[C@H]1O[C@@H](n2c(Br)nc3c(NC(=S)NCc4ccccc4)ncnc32)[C@H](O)[C@@H]1OAglycone:
S=C(NCc1ccccc1)Nc1ncnc2c1N=C(Br)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.33 |
AlogP: | 0.69 | Num_rotatable_bonds: | 5 |
MolWt: | 495.36 | Num_heavy_atoms: | 30 |
TPSA: | 137.58 | NumAromaticRings: | 3 |
Unique Aglycone
AD43376
Formula: C13H10N6SBr
Smiles:
S=C(NCc1ccccc1)Nc1ncnc2c1N=C(Br)[N]2HBA: | 6 | RingCount: | 3 |
HBD: | 2 | FractionCSP3: | 0.08 |
AlogP: | 2.6 | Num_rotatable_bonds: | 3 |
MolWt: | 362.24 | Num_heavy_atoms: | 21 |
TPSA: | 76.3 | NumAromaticRings: | 2 |