Glycoside
GD040020
Name:
2'-o-methyl-5'-o-thiophosphonoguanosineFormula:
C11H16O7N5PSSmiles:
CO[C@@H]1[C@@H](O)[C@@H](COP(O)(O)=S)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21Aglycone:
COP(O)(O)=S.Nc1nc2c(c(=O)[nH]1)N=C[N]2Sugarmoiety:
COC1C(O)OC(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -1.8 | Num_rotatable_bonds: | 5 |
| MolWt: | 393.32 | Num_heavy_atoms: | 25 |
| TPSA: | 177.97 | NumAromaticRings: | 2 |
Unique Aglycone
AD00206
Formula: CH5O3PS
Smiles:
COP(O)(O)=S| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 1 |
| MolWt: | 128.09 | Num_heavy_atoms: | 6 |
| TPSA: | 49.69 | NumAromaticRings: | 0 |
AD00207
Formula: C5H4ON5
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.12 | Num_heavy_atoms: | 11 |
| TPSA: | 98.23 | NumAromaticRings: | 1 |
