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canSAR2048315
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NAMES
    SMILES
    CN1CCC(N(C)CC2CCN(c3nc(N4CCNCC4)nc4scc(-c5ccccc5)c34)CC2)C1
    InChI
    InChI=1S/C28H39N7S/c1-32-13-10-23(19-32)33(2)18-21-8-14-34(15-9-21)26-25-24(22-6-4-3-5-7-22)20-36-27(25)31-28(30-26)35-16-11-29-12-17-35/h3-7,20-21,23,29H,8-19H2,1-2H3
    MOLECULAR FORMULA
    C28H39N7S
    CROSS REFERENCES
    2048315 logo

    canSAR2048315

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 505.30
    AlogP 3.62
    HBond donors 1
    HBond acceptors 7
    Atoms 75
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2048315.