GD036347

Name:

None

Formula:

C13H18O7N6S

Smiles:

C=CCOc1nn([C@@H]2O[C@H](COS(N)(=O)=O)[C@H](O)[C@H]2O)c2ncnc(N)c12

Aglycone:

C=CCOC1=N[N]c2ncnc(N)c21.COS(N)(=O)=O

Sugarmoiety:

OC1OC(O)C(O)C1O

Other Identifiers

• CHEMBL4567514

AD00036

Formula: CH5O3NS

Smiles:

COS(N)(=O)=O

HBA:	4	RingCount:	0
HBD:	2	FractionCSP3:	1.0
AlogP:	-1.16	Num_rotatable_bonds:	1
MolWt:	111.12	Num_heavy_atoms:	6
TPSA:	69.39	NumAromaticRings:	0

AD22933

Formula: C8H8ON5

Smiles:

C=CCOC1=N[N]c2ncnc(N)c21

HBA:	6	RingCount:	2
HBD:	2	FractionCSP3:	0.12
AlogP:	0.17	Num_rotatable_bonds:	2
MolWt:	190.19	Num_heavy_atoms:	14
TPSA:	87.49	NumAromaticRings:	1