canSAR2257490
FEATURES
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NAMES
    SMILES
    Cc1cc(OCCCc2c3n(c4c(-c5c(C)nn(C)c5C)c(Cl)ccc24)CCCN(c2cc(C(=O)O)cc4c2OCO4)C3=O)cc(C)c1Cl
    InChI
    InChI=1S/C37H36Cl2N4O6/c1-19-14-24(15-20(2)32(19)39)47-13-6-8-25-26-9-10-27(38)31(30-21(3)40-41(5)22(30)4)33(26)43-12-7-11-42(36(44)34(25)43)28-16-23(37(45)46)17-29-35(28)49-18-48-29/h9-10,14-17H,6-8,11-13,18H2,1-5H3,(H,45,46)
    MOLECULAR FORMULA
    C37H36Cl2N4O6
    CROSS REFERENCES
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    canSAR2257490
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight702.20
    AlogP8.07
    HBond donors1
    HBond acceptors10
    Atoms85
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2257490.