Glycoside
GD077719
Name:
NoneFormula:
C16H14O5N5ClSmiles:
OC[C@H]1O[C@@H](n2cnc3c(Oc4cncc(Cl)c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Clc1cncc(Oc2ncnc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 4 |
| MolWt: | 379.76 | Num_heavy_atoms: | 26 |
| TPSA: | 135.64 | NumAromaticRings: | 3 |
Unique Aglycone
AD35589
Formula: C11H5ON5Cl
Smiles:
Clc1cncc(Oc2ncnc3c2N=C[N]3)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.23 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.64 | Num_heavy_atoms: | 17 |
| TPSA: | 74.36 | NumAromaticRings: | 2 |
