Glycoside
GD091966
Name:
NoneFormula:
C20H22O5N5FSmiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CC[C@@](O)(c5ccc(F)cc5)C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OC1(c2ccc(F)cc2)CCN(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 431.42 | Num_heavy_atoms: | 31 |
| TPSA: | 136.99 | NumAromaticRings: | 3 |
Unique Aglycone
AD40135
Formula: C15H13ON5F
Smiles:
OC1(c2ccc(F)cc2)CCN(c2ncnc3c2N=C[N]3)C1| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 298.3 | Num_heavy_atoms: | 22 |
| TPSA: | 75.71 | NumAromaticRings: | 2 |
