Glycoside
GD016589
Name:
NoneFormula:
C18H21O4N5SSmiles:
CSc1cccc(Nc2ncnc3c2ncn3C2O[C@H](CO)[C@H](O)[C@]2(C)O)c1Aglycone:
CSc1cccc(Nc2ncnc3c2N=C[N]3)c1Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 403.46 | Num_heavy_atoms: | 28 |
| TPSA: | 125.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD11927
Formula: C12H10N5S
Smiles:
CSc1cccc(Nc2ncnc3c2N=C[N]3)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.85 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.31 | Num_heavy_atoms: | 18 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
