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canSAR1525660
FEATURES
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NAMES
    SMILES
    COc1cc(CN(C[C@H]2CC[C@H](C(=O)O)CC2)[C@H]2CCc3cc(Cl)ccc32)ccc1OCCN1C(=O)CCC1=O
    InChI
    InChI=1S/C31H37ClN2O6/c1-39-28-16-21(4-11-27(28)40-15-14-34-29(35)12-13-30(34)36)19-33(18-20-2-5-22(6-3-20)31(37)38)26-10-7-23-17-24(32)8-9-25(23)26/h4,8-9,11,16-17,20,22,26H,2-3,5-7,10,12-15,18-19H2,1H3,(H,37,38)/t20-,22-,26-/m0/s1
    MOLECULAR FORMULA
    C31H37ClN2O6
    CROSS REFERENCES
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    canSAR1525660

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 568.23
    AlogP 5.26
    HBond donors 1
    HBond acceptors 8
    Atoms 77
    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 canSAR1525660.