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canSAR1718646
FEATURES
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NAMES
    SMILES
    Cc1ccsc1C(=O)N1CCC(N2CCC(C(=O)NCC3CCCO3)CC2)CC1
    InChI
    InChI=1S/C22H33N3O3S/c1-16-8-14-29-20(16)22(27)25-11-6-18(7-12-25)24-9-4-17(5-10-24)21(26)23-15-19-3-2-13-28-19/h8,14,17-19H,2-7,9-13,15H2,1H3,(H,23,26)
    MOLECULAR FORMULA
    C22H33N3O3S
    CROSS REFERENCES
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    canSAR1718646

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.22
    AlogP 2.67
    HBond donors 1
    HBond acceptors 6
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1718646.