Glycoside
GD083977
Name:
NoneFormula:
C20H21O4N7Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CC(c5nc6ccccc6[nH]5)C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N2CC(c3nc4ccccc4[nH]3)C2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 423.43 | Num_heavy_atoms: | 31 |
| TPSA: | 145.44 | NumAromaticRings: | 4 |
Unique Aglycone
AD37459
Formula: C15H12N7
Smiles:
C1=Nc2c(ncnc2N2CC(c3nc4ccccc4[nH]3)C2)[N]1| HBA: | 7 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 290.31 | Num_heavy_atoms: | 22 |
| TPSA: | 84.16 | NumAromaticRings: | 3 |
