Glycoside
GD068408
Name:
NoneFormula:
C15H18O4N5FSmiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCC=C(F)C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
FC1=CCCN(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 351.34 | Num_heavy_atoms: | 25 |
| TPSA: | 116.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD32407
Formula: C10H9N5F
Smiles:
FC1=CCCN(c2ncnc3c2N=C[N]3)C1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 1 |
| MolWt: | 218.22 | Num_heavy_atoms: | 16 |
| TPSA: | 55.48 | NumAromaticRings: | 1 |
