canSAR856593
FEATURES
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NAMES
    SMILES
    CO[C@H]1C[C@@](O)(Cc2ccccc2)C(=O)N2[C@H](C(=O)NCc3ccc(C(=N)N)cc3)CC[C@@H]12.Cl
    InChI
    InChI=1S/C25H30N4O4.ClH/c1-33-21-14-25(32,13-16-5-3-2-4-6-16)24(31)29-19(21)11-12-20(29)23(30)28-15-17-7-9-18(10-8-17)22(26)27;/h2-10,19-21,32H,11-15H2,1H3,(H3,26,27)(H,28,30);1H/t19-,20-,21-,25-;/m0./s1
    MOLECULAR FORMULA
    C25H31ClN4O4
    CROSS REFERENCES
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    canSAR856593
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight486.20
    AlogP1.76
    HBond donors5
    HBond acceptors8
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR856593.