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canSAR1595784
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NAMES
    SMILES
    CC(=O)N[C@@H](C)c1ccc(OC2CN(c3nc4ccccc4s3)C2)cc1
    InChI
    InChI=1S/C20H21N3O2S/c1-13(21-14(2)24)15-7-9-16(10-8-15)25-17-11-23(12-17)20-22-18-5-3-4-6-19(18)26-20/h3-10,13,17H,11-12H2,1-2H3,(H,21,24)/t13-/m0/s1
    MOLECULAR FORMULA
    C20H21N3O2S
    CROSS REFERENCES
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    canSAR1595784

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 367.14
    AlogP 3.76
    HBond donors 1
    HBond acceptors 5
    Atoms 47
    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 canSAR1595784.