can
SAR
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canSAR1846356
FEATURES
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NAMES
SMILES
Nc1nnc(CC(=O)NN=Cc2cc([N+](=O)[O-])ccc2O)s1
InChI
InChI=1S/C11H10N6O4S/c12-11-16-15-10(22-11)4-9(19)14-13-5-6-3-7(17(20)21)1-2-8(6)18/h1-3,5,18H,4H2,(H2,12,16)(H,14,19)
MOLECULAR FORMULA
C11H10N6O4S
CROSS REFERENCES
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canSAR1846356
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Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight
322.05
AlogP
0.43
HBond donors
4
HBond acceptors
10
Atoms
32
Contains toxicophore
Yes
Contains PAINS
Yes
Commercially available
Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by canSAR1846356.