1443451 logo
canSAR1443451
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cc(C)cc(=O)n2C)C3=O)c(OC)n1
    InChI
    InChI=1S/C27H27ClN6O4/c1-14(2)33-23-21(30-24(33)18-13-29-27(38-6)31-25(18)37-5)26(36)34(19-11-15(3)12-20(35)32(19)4)22(23)16-7-9-17(28)10-8-16/h7-14,22H,1-6H3
    MOLECULAR FORMULA
    C27H27ClN6O4
    CROSS REFERENCES
    1443451 logo

    canSAR1443451

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 534.18
    AlogP 4.35
    HBond donors 0
    HBond acceptors 10
    Atoms 65
    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 canSAR1443451.