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canSAR1620386
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NAMES
    SMILES
    Cc1occc1-c1nnc(SCC(=O)N2CC(=O)Nc3ccccc32)n1CC(C)C
    InChI
    InChI=1S/C21H23N5O3S/c1-13(2)10-26-20(15-8-9-29-14(15)3)23-24-21(26)30-12-19(28)25-11-18(27)22-16-6-4-5-7-17(16)25/h4-9,13H,10-12H2,1-3H3,(H,22,27)
    MOLECULAR FORMULA
    C21H23N5O3S
    CROSS REFERENCES
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    canSAR1620386

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.15
    AlogP 3.58
    HBond donors 1
    HBond acceptors 8
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1620386.