Glycoside
GD039388
Name:
9-(6-carbamimidamido-5,6-dideoxy-beta-d-ribo-hexofuranosyl)-9h-purin-6-amineFormula:
C12H18O3N8Smiles:
N=C(N)NCC[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OAglycone:
CCNC(=N)N.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.5 |
| AlogP: | -2.1 | Num_rotatable_bonds: | 4 |
| MolWt: | 322.33 | Num_heavy_atoms: | 23 |
| TPSA: | 181.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD17533
Formula: C3H9N3
Smiles:
CCNC(=N)N| HBA: | 3 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 1 |
| MolWt: | 87.13 | Num_heavy_atoms: | 6 |
| TPSA: | 61.9 | NumAromaticRings: | 0 |
