can
SAR
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canSAR2079962
FEATURES
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NAMES
SMILES
O=C(O)c1cn(C2CC2)c2cc(N3CCN(C(=O)c4cccnc4Cl)CC3)c(F)cc2c1=O
InChI
InChI=1S/C23H20ClFN4O4/c24-21-14(2-1-5-26-21)22(31)28-8-6-27(7-9-28)19-11-18-15(10-17(19)25)20(30)16(23(32)33)12-29(18)13-3-4-13/h1-2,5,10-13H,3-4,6-9H2,(H,32,33)
MOLECULAR FORMULA
C23H20ClFN4O4
CROSS REFERENCES
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canSAR2079962
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Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight
470.12
AlogP
3.18
HBond donors
1
HBond acceptors
8
Atoms
53
Contains toxicophore
Yes
Contains PAINS
No
Commercially available
Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by canSAR2079962.