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canSAR1988242
FEATURES
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NAMES
    SMILES
    CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
    InChI
    InChI=1S/C24H22ClN5O2/c1-2-21-19(6-3-15-4-8-22(26)27-12-15)23(29-14-28-21)16-5-7-18(20(25)11-16)24(32)30-10-9-17(31)13-30/h4-5,7-8,11-12,14,17,31H,2,9-10,13H2,1H3,(H2,26,27)/t17-/m1/s1
    MOLECULAR FORMULA
    C24H22ClN5O2
    CROSS REFERENCES
    1988242 logo

    canSAR1988242

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.15
    AlogP 2.94
    HBond donors 3
    HBond acceptors 7
    Atoms 54
    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 canSAR1988242.