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canSAR1145257
FEATURES
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NAMES
    SMILES
    CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](c2ccccc2)C[C@H]1C(=O)NCc1c[nH]c2ccccc12)C(C)(C)C
    InChI
    InChI=1S/C30H39N5O3/c1-19(31-5)27(36)34-26(30(2,3)4)29(38)35-18-21(20-11-7-6-8-12-20)15-25(35)28(37)33-17-22-16-32-24-14-10-9-13-23(22)24/h6-14,16,19,21,25-26,31-32H,15,17-18H2,1-5H3,(H,33,37)(H,34,36)/t19-,21+,25-,26+/m0/s1
    MOLECULAR FORMULA
    C30H39N5O3
    CROSS REFERENCES
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    canSAR1145257

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 517.31
    AlogP 3.31
    HBond donors 4
    HBond acceptors 8
    Atoms 77
    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 canSAR1145257.