Glycoside
GD024310
Name:
NoneFormula:
C21H21O4N6ClSSmiles:
CCCNc1nc(C#Cc2ccc(Cl)s2)nc2c1ncn2[C@@H]1O[C@H](C(=O)NC)[C@H](O)[C@H]1OAglycone:
CCCNc1nc(C#Cc2ccc(Cl)s2)nc2c1N=C[N]2Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 5 |
| MolWt: | 476.95 | Num_heavy_atoms: | 32 |
| TPSA: | 134.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD16239
Formula: C15H11N5ClS
Smiles:
CCCNc1nc(C#Cc2ccc(Cl)s2)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.8 | Num_heavy_atoms: | 21 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
