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canSAR1445430
FEATURES
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NAMES
    SMILES
    COc1ccc(OC2C=CC(c3ccccc3)OC2COC(=O)CCC(C)=NOC2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)cc1
    InChI
    InChI=1S/C38H45NO15/c1-22(39-54-38-37(50-26(5)43)36(49-25(4)42)35(48-24(3)41)33(53-38)21-46-23(2)40)12-19-34(44)47-20-32-31(51-29-15-13-28(45-6)14-16-29)18-17-30(52-32)27-10-8-7-9-11-27/h7-11,13-18,30-33,35-38H,12,19-21H2,1-6H3
    MOLECULAR FORMULA
    C38H45NO15
    CROSS REFERENCES
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    canSAR1445430

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 755.28
    AlogP 3.94
    HBond donors 0
    HBond acceptors 16
    Atoms 99
    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 canSAR1445430.