Glycoside
GD039474
Name:
5'-o-[(2-phenylethyl)carbamoyl]guanosineFormula:
C19H22O6N6Smiles:
Nc1nc2c(ncn2[C@H]2O[C@H](COC(=O)NCCc3ccccc3)[C@@H](O)[C@H]2O)c(=O)[nH]1Aglycone:
COC(=O)NCCc1ccccc1.Nc1nc2c(c(=O)[nH]1)N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.37 |
| AlogP: | -0.71 | Num_rotatable_bonds: | 6 |
| MolWt: | 430.42 | Num_heavy_atoms: | 31 |
| TPSA: | 177.61 | NumAromaticRings: | 3 |
Unique Aglycone
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 |
AD18021
Formula: C10H13O2N
Smiles:
COC(=O)NCCc1ccccc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 179.22 | Num_heavy_atoms: | 13 |
| TPSA: | 38.33 | NumAromaticRings: | 1 |
