Glycoside
GD127971
Name:
2-(hydroxymethyl)-5-(6-{[(5-hydroxypyridin-2-yl)methyl]amino}-9H-purin-9-yl)oxolane-3,4-diolFormula:
C16H18O5N6Smiles:
OCC1OC(n2cnc3c(NCc4ccc(O)cn4)ncnc32)C(O)C1OAglycone:
Oc1ccc(CNc2ncnc3c2N=C[N]3)nc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 374.36 | Num_heavy_atoms: | 27 |
| TPSA: | 158.67 | NumAromaticRings: | 3 |
Unique Aglycone
AD51841
Formula: C11H9ON6
Smiles:
Oc1ccc(CNc2ncnc3c2N=C[N]3)nc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 241.23 | Num_heavy_atoms: | 18 |
| TPSA: | 97.39 | NumAromaticRings: | 2 |
