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canSAR1617661
FEATURES
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NAMES
    SMILES
    CC(C)N1CCC[C@@H](COc2ccnc3ccc(C#CCNC(=O)c4cccn(Cc5ccc(F)c(F)c5)c4=O)cc23)C1
    InChI
    InChI=1S/C34H34F2N4O3/c1-23(2)39-16-4-7-26(21-39)22-43-32-13-15-37-31-12-10-24(18-28(31)32)6-3-14-38-33(41)27-8-5-17-40(34(27)42)20-25-9-11-29(35)30(36)19-25/h5,8-13,15,17-19,23,26H,4,7,14,16,20-22H2,1-2H3,(H,38,41)/t26-/m1/s1
    MOLECULAR FORMULA
    C34H34F2N4O3
    CROSS REFERENCES
    1617661 logo

    canSAR1617661

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 584.26
    AlogP 5.00
    HBond donors 1
    HBond acceptors 7
    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 canSAR1617661.