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canSAR1963270
FEATURES
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NAMES
    SMILES
    CCCc1[nH]c(=O)c(Cc2cc3cc(OC)ccc3nc2NCCNC(C)=O)c2cc(OC)c(OC)cc12
    InChI
    InChI=1S/C29H34N4O5/c1-6-7-25-22-16-27(38-5)26(37-4)15-21(22)23(29(35)33-25)14-19-12-18-13-20(36-3)8-9-24(18)32-28(19)31-11-10-30-17(2)34/h8-9,12-13,15-16H,6-7,10-11,14H2,1-5H3,(H,30,34)(H,31,32)(H,33,35)
    MOLECULAR FORMULA
    C29H34N4O5
    CROSS REFERENCES
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    canSAR1963270

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 518.25
    AlogP 4.19
    HBond donors 3
    HBond acceptors 9
    Atoms 72
    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 canSAR1963270.