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canSAR646472
FEATURES
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NAMES
    SMILES
    CN(C)CCCCN1c2ccccc2Sc2ccc(C(=O)c3ccccc3)cc21
    InChI
    InChI=1S/C25H26N2OS/c1-26(2)16-8-9-17-27-21-12-6-7-13-23(21)29-24-15-14-20(18-22(24)27)25(28)19-10-4-3-5-11-19/h3-7,10-15,18H,8-9,16-17H2,1-2H3
    MOLECULAR FORMULA
    C25H26N2OS
    CROSS REFERENCES
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    canSAR646472

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.18
    AlogP 5.86
    HBond donors 0
    HBond acceptors 3
    Atoms 55
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR646472.