1965038 logo
canSAR1965038
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(c1cnc2ccc(-c3ccc(O)c(Cl)c3)cc2c1Nc1cnn(C2CCNCC2)c1)C1CC1
    InChI
    InChI=1S/C27H26ClN5O2/c28-23-12-18(4-6-25(23)34)17-3-5-24-21(11-17)26(22(14-30-24)27(35)16-1-2-16)32-19-13-31-33(15-19)20-7-9-29-10-8-20/h3-6,11-16,20,29,34H,1-2,7-10H2,(H,30,32)
    MOLECULAR FORMULA
    C27H26ClN5O2
    CROSS REFERENCES
    1965038 logo

    canSAR1965038

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 487.18
    AlogP 5.72
    HBond donors 3
    HBond acceptors 7
    Atoms 61
    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 canSAR1965038.