canSAR1134397
FEATURES
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NAMES
    SMILES
    Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(C(C)(C)C)c1
    InChI
    InChI=1S/C19H25N5O2S/c1-11-15(12-7-8-21-14(10-12)19(2,3)4)27-17(22-11)23-18(26)24-9-5-6-13(24)16(20)25/h7-8,10,13H,5-6,9H2,1-4H3,(H2,20,25)(H,22,23,26)/t13-/m0/s1
    MOLECULAR FORMULA
    C19H25N5O2S
    CROSS REFERENCES
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    canSAR1134397
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight387.17
    AlogP3.29
    HBond donors3
    HBond acceptors7
    Atoms52
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1134397.