canSAR823158
FEATURES
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NAMES
    SMILES
    C#CCN(Cc1ccc2nc(C)nc(O)c2c1)c1ccc(C(=O)N[C@H](CCC(=O)NCCCC)C(=O)O)cc1
    InChI
    InChI=1S/C29H33N5O5/c1-4-6-15-30-26(35)14-13-25(29(38)39)33-27(36)21-8-10-22(11-9-21)34(16-5-2)18-20-7-12-24-23(17-20)28(37)32-19(3)31-24/h2,7-12,17,25H,4,6,13-16,18H2,1,3H3,(H,30,35)(H,33,36)(H,38,39)(H,31,32,37)/t25-/m1/s1
    MOLECULAR FORMULA
    C29H33N5O5
    CROSS REFERENCES
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    canSAR823158
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight531.25
    AlogP3.16
    HBond donors4
    HBond acceptors10
    Atoms72
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823158.