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canSAR846253
FEATURES
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NAMES
    SMILES
    CCC(=O)NNC(=O)C1CC23C=CC1(OC)C1Oc4c(OC)ccc5c4C12CCN(C)C3C5
    InChI
    InChI=1S/C25H31N3O5/c1-5-18(29)26-27-21(30)15-13-23-8-9-25(15,32-4)22-24(23)10-11-28(2)17(23)12-14-6-7-16(31-3)20(33-22)19(14)24/h6-9,15,17,22H,5,10-13H2,1-4H3,(H,26,29)(H,27,30)/t15-,17-,22-,23?,24+,25-/m1/s1
    MOLECULAR FORMULA
    C25H31N3O5
    CROSS REFERENCES
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    canSAR846253

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 453.23
    AlogP 1.47
    HBond donors 2
    HBond acceptors 8
    Atoms 64
    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 canSAR846253.