Glycoside
GD154845
Name:
2-{6-[bis(2-hydroxyethyl)amino]-9H-purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C14H21O6N5Smiles:
OCCN(CCO)c1ncnc2c1ncn2C1OC(CO)C(O)C1OAglycone:
OCCN(CCO)c1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -2.77 | Num_rotatable_bonds: | 7 |
| MolWt: | 355.35 | Num_heavy_atoms: | 25 |
| TPSA: | 157.22 | NumAromaticRings: | 2 |
Unique Aglycone
AD61466
Formula: C9H12O2N5
Smiles:
OCCN(CCO)c1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 222.23 | Num_heavy_atoms: | 16 |
| TPSA: | 95.94 | NumAromaticRings: | 1 |
