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canSAR1444024
FEATURES
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NAMES
    SMILES
    CC(C)CN(Cc1cc(Cl)c2c(c1)OCCCO2)C(=O)C1CCCN(Cc2cccc([N+](=O)[O-])c2)C1
    InChI
    InChI=1S/C27H34ClN3O5/c1-19(2)15-30(17-21-13-24(28)26-25(14-21)35-10-5-11-36-26)27(32)22-7-4-9-29(18-22)16-20-6-3-8-23(12-20)31(33)34/h3,6,8,12-14,19,22H,4-5,7,9-11,15-18H2,1-2H3
    MOLECULAR FORMULA
    C27H34ClN3O5
    CROSS REFERENCES
    1444024 logo

    canSAR1444024

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 515.22
    AlogP 5.31
    HBond donors 0
    HBond acceptors 8
    Atoms 70
    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 canSAR1444024.