Glycoside
GD002655
Name:
NoneFormula:
C18H24O4N5ClSmiles:
OC[C@@H]1OC(n2cnc3c(NC4CCCCCC4)nc(Cl)nc32)[C@H](O)[C@H]1OAglycone:
Clc1nc2c(c(NC3CCCCCC3)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 397.86 | Num_heavy_atoms: | 27 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD02506
Formula: C13H15N5Cl
Smiles:
Clc1nc2c(c(NC3CCCCCC3)n1)N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 3.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 264.74 | Num_heavy_atoms: | 18 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
