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canSAR467000
FEATURES
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NAMES
    SMILES
    CC(C)Oc1cc(-c2ccc(C[C@@H](C)NC[C@H](O)c3ccccc3)cc2)ccc1C(=O)O
    InChI
    InChI=1S/C27H31NO4/c1-18(2)32-26-16-23(13-14-24(26)27(30)31)21-11-9-20(10-12-21)15-19(3)28-17-25(29)22-7-5-4-6-8-22/h4-14,16,18-19,25,28-29H,15,17H2,1-3H3,(H,30,31)/t19-,25+/m1/s1
    MOLECULAR FORMULA
    C27H31NO4
    CROSS REFERENCES
    467000 logo

    canSAR467000

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 433.23
    AlogP 5.09
    HBond donors 3
    HBond acceptors 5
    Atoms 63
    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 canSAR467000.