Glycoside
GD078742
Name:
NoneFormula:
C17H21O3N6SSmiles:
CSC[C@H]1O[C@@H](n2cnc3c(Nc4cc[nH+]c(C)c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Cc1cc(Nc2ncnc3c2N=C[N]3)cc[nH+]1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 389.46 | Num_heavy_atoms: | 27 |
| TPSA: | 119.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD36190
Formula: C11H10N6
Smiles:
Cc1cc(Nc2ncnc3c2N=C[N]3)cc[nH+]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 226.24 | Num_heavy_atoms: | 17 |
| TPSA: | 78.41 | NumAromaticRings: | 2 |
