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canSAR1619510
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NAMES
    SMILES
    Cc1cnc(N[C@H]2C[C@H]2CO)nc1-c1c[nH]c(C(=O)N[C@H](CO)c2ccccc2)c1
    InChI
    InChI=1S/C22H25N5O3/c1-13-9-24-22(26-17-8-16(17)11-28)27-20(13)15-7-18(23-10-15)21(30)25-19(12-29)14-5-3-2-4-6-14/h2-7,9-10,16-17,19,23,28-29H,8,11-12H2,1H3,(H,25,30)(H,24,26,27)/t16-,17-,19+/m0/s1
    MOLECULAR FORMULA
    C22H25N5O3
    CROSS REFERENCES
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    canSAR1619510

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 407.20
    AlogP 2.04
    HBond donors 5
    HBond acceptors 8
    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 canSAR1619510.