Glycoside
GD090685
Name:
NoneFormula:
C20H23O6N5Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc3nnc(-c4cccnc4)n3c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccc2nnc(-c3cccnc3)n2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 429.43 | Num_heavy_atoms: | 31 |
| TPSA: | 151.33 | NumAromaticRings: | 3 |
Unique Aglycone
AD39465
Formula: C14H13O2N5
Smiles:
O=C(NCCO)c1ccc2nnc(-c3cccnc3)n2c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 283.29 | Num_heavy_atoms: | 21 |
| TPSA: | 92.41 | NumAromaticRings: | 3 |
