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canSAR1062011
FEATURES
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NAMES
    SMILES
    COc1cccc(C(=O)NC2CC3CCC(C2)N3c2ccc(C(N)=O)cn2)c1C
    InChI
    InChI=1S/C22H26N4O3/c1-13-18(4-3-5-19(13)29-2)22(28)25-15-10-16-7-8-17(11-15)26(16)20-9-6-14(12-24-20)21(23)27/h3-6,9,12,15-17H,7-8,10-11H2,1-2H3,(H2,23,27)(H,25,28)
    MOLECULAR FORMULA
    C22H26N4O3
    CROSS REFERENCES
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    canSAR1062011

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.20
    AlogP 2.43
    HBond donors 3
    HBond acceptors 7
    Atoms 55
    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 canSAR1062011.