Glycoside
GD012398
Name:
NoneFormula:
C15H18O4N5ClSmiles:
O[C@H]1[C@H](O)[C@H](CCl)O[C@@H]1n1cnc2c(N[C@@H]3CCOC3)ncnc21Aglycone:
C1=Nc2c(ncnc2NC2CCOC2)[N]1Sugarmoiety:
OC1OC(CCl)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.64 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 355.78 | Num_heavy_atoms: | 24 |
| TPSA: | 114.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD01177
Formula: C9H10ON5
Smiles:
C1=Nc2c(ncnc2NC2CCOC2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 204.21 | Num_heavy_atoms: | 15 |
| TPSA: | 73.5 | NumAromaticRings: | 1 |
