Glycoside
GD143757
Name:
4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidine-2-thioneFormula:
C9H13O4N3SSmiles:
N=c1ccn(C2OC(CO)C(O)C2O)c(S)n1Aglycone:
N=C1C=C[N]C(S)=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -1.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 259.29 | Num_heavy_atoms: | 17 |
| TPSA: | 111.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD57798
Formula: C4H4N3S
Smiles:
N=C1C=C[N]C(S)=N1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 0 |
| MolWt: | 126.16 | Num_heavy_atoms: | 8 |
| TPSA: | 50.31 | NumAromaticRings: | 0 |
