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canSAR1443914
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NAMES
    SMILES
    O=C(CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1)NC1CCCC1
    InChI
    InChI=1S/C22H22N4OS/c27-19(23-18-13-7-8-14-18)15-28-22-24-20(16-9-3-1-4-10-16)21(25-26-22)17-11-5-2-6-12-17/h1-6,9-12,18H,7-8,13-15H2,(H,23,27)
    MOLECULAR FORMULA
    C22H22N4OS
    CROSS REFERENCES
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    canSAR1443914

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.15
    AlogP 4.36
    HBond donors 1
    HBond acceptors 5
    Atoms 50
    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 canSAR1443914.