can
SAR
Black
canSAR1846499
FEATURES
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NAMES
SMILES
C/C(NCCCN(C)C)=C(/C#N)C(N)=O
InChI
InChI=1S/C10H18N4O/c1-8(9(7-11)10(12)15)13-5-4-6-14(2)3/h13H,4-6H2,1-3H3,(H2,12,15)/b9-8+
MOLECULAR FORMULA
C10H18N4O
CROSS REFERENCES
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canSAR1846499
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Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight
210.15
AlogP
-0.19
HBond donors
3
HBond acceptors
5
Atoms
33
Contains toxicophore
Yes
Contains PAINS
No
Commercially available
Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by canSAR1846499.