Glycoside
GD086074
Name:
NoneFormula:
C18H25O3N7SSmiles:
CSC[C@H]1O[C@@H](n2cnc3c(Nc4cnn(C(C)(C)C)c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)n1cc(Nc2ncnc3c2N=C[N]3)cn1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 419.51 | Num_heavy_atoms: | 29 |
| TPSA: | 123.14 | NumAromaticRings: | 3 |
Unique Aglycone
AD38258
Formula: C12H14N7
Smiles:
CC(C)(C)n1cc(Nc2ncnc3c2N=C[N]3)cn1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 256.29 | Num_heavy_atoms: | 19 |
| TPSA: | 82.09 | NumAromaticRings: | 2 |
