Glycoside
GD068805
Name:
NoneFormula:
C17H23O4N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCC[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N2CCCC2C2CC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 361.4 | Num_heavy_atoms: | 26 |
| TPSA: | 116.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD32610
Formula: C12H14N5
Smiles:
C1=Nc2c(ncnc2N2CCCC2C2CC2)[N]1| HBA: | 5 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.58 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 2 |
| MolWt: | 228.28 | Num_heavy_atoms: | 17 |
| TPSA: | 55.48 | NumAromaticRings: | 1 |
