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canSAR169022
FEATURES
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NAMES
    SMILES
    CC(C)CCN(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)c1ccccc1
    InChI
    InChI=1S/C30H39N5O4/c1-19(2)15-16-35(5)30(39)26(17-23-18-31-25-14-10-9-13-24(23)25)34-28(37)21(4)32-27(36)20(3)33-29(38)22-11-7-6-8-12-22/h6-14,18-21,26,31H,15-17H2,1-5H3,(H,32,36)(H,33,38)(H,34,37)/t20-,21-,26+/m0/s1
    MOLECULAR FORMULA
    C30H39N5O4
    CROSS REFERENCES
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    canSAR169022

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 533.30
    AlogP 3.02
    HBond donors 4
    HBond acceptors 9
    Atoms 78
    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 canSAR169022.