Glycoside
GD036725
Name:
NoneFormula:
C26H29O6N6FSmiles:
COc1cccc(-c2cc(F)ccc2[C@@H]2Cc3nc(N)nc(C)c3C(NOCC3O[C@H](OC)[C@H](O)[C@H]3O)=N2)n1Aglycone:
CONC1=NC(c2ccc(F)cc2-c2cccc(OC)n2)Cc2nc(N)nc(C)c21Sugarmoiety:
COC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 7 |
| MolWt: | 540.55 | Num_heavy_atoms: | 39 |
| TPSA: | 166.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD23169
Formula: C21H21O2N6F
Smiles:
CONC1=NC(c2ccc(F)cc2-c2cccc(OC)n2)Cc2nc(N)nc(C)c21| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.24 |
| AlogP: | 2.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 408.44 | Num_heavy_atoms: | 30 |
| TPSA: | 107.54 | NumAromaticRings: | 3 |
