canSAR1585929
FEATURES
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NAMES
    SMILES
    COc1cc(-c2cc(C(=O)N[C@H]3CC[C@@H](CO)CC3)c3c(N)ncnn23)ccn1
    InChI
    InChI=1S/C20H24N6O3/c1-29-17-8-13(6-7-22-17)16-9-15(18-19(21)23-11-24-26(16)18)20(28)25-14-4-2-12(10-27)3-5-14/h6-9,11-12,14,27H,2-5,10H2,1H3,(H,25,28)(H2,21,23,24)/t12-,14+
    MOLECULAR FORMULA
    C20H24N6O3
    CROSS REFERENCES
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    canSAR1585929
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight396.19
    AlogP1.66
    HBond donors4
    HBond acceptors9
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1585929.