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canSAR1768172
FEATURES
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NAMES
    SMILES
    CCN(CC)C(=O)[C@H]1C[C@H](CC(=O)NCc2ccc(OC)c(OC)c2)C(=O)N2CCc3c([nH]c4ccc(Cl)cc34)[C@]12C
    InChI
    InChI=1S/C32H39ClN4O5/c1-6-36(7-2)31(40)24-15-20(16-28(38)34-18-19-8-11-26(41-4)27(14-19)42-5)30(39)37-13-12-22-23-17-21(33)9-10-25(23)35-29(22)32(24,37)3/h8-11,14,17,20,24,35H,6-7,12-13,15-16,18H2,1-5H3,(H,34,38)/t20-,24-,32+/m1/s1
    MOLECULAR FORMULA
    C32H39ClN4O5
    CROSS REFERENCES
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    canSAR1768172

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 594.26
    AlogP 4.65
    HBond donors 2
    HBond acceptors 9
    Atoms 81
    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 canSAR1768172.