Glycoside
GD133983
Name:
5-Amino-6-(5-Phospho-Beta-D-Ribosylamino)UracilFormula:
C9H15O9N4PSmiles:
Nc1c(O)nc(O)nc1NC1OC(COP(=O)(O)O)C(O)C1OAglycone:
COP(=O)(O)O.Nc1nc(O)nc(O)c1NSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.56 |
| AlogP: | -2.56 | Num_rotatable_bonds: | 5 |
| MolWt: | 354.21 | Num_heavy_atoms: | 23 |
| TPSA: | 220.74 | NumAromaticRings: | 1 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD54204
Formula: C4H6O2N4
Smiles:
Nc1nc(O)nc(O)c1N| HBA: | 6 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.0 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 0 |
| MolWt: | 142.12 | Num_heavy_atoms: | 10 |
| TPSA: | 118.28 | NumAromaticRings: | 1 |
