Glycoside
GD010300
Name:
NoneFormula:
C20H25O3N5SSmiles:
CSC[C@@H]1OC(n2cnc3c(N[C@H](C)Cc4ccccc4)ncnc32)[C@H](O)[C@H]1OAglycone:
CC(Cc1ccccc1)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 7 |
| MolWt: | 415.52 | Num_heavy_atoms: | 29 |
| TPSA: | 105.32 | NumAromaticRings: | 3 |
Unique Aglycone
AD01412
Formula: C14H14N5
Smiles:
CC(Cc1ccccc1)Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 252.3 | Num_heavy_atoms: | 19 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
