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canSAR1087941
FEATURES
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NAMES
    SMILES
    C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCCC(=O)CCl)NC1=O
    InChI
    InChI=1S/C26H35ClN4O5/c1-17-23(33)29-20(12-7-3-6-11-19(32)16-27)26(36)31-14-8-13-22(31)25(35)30-21(24(34)28-17)15-18-9-4-2-5-10-18/h2,4-5,9-10,17,20-22H,3,6-8,11-16H2,1H3,(H,28,34)(H,29,33)(H,30,35)/t17-,20-,21-,22-/m0/s1
    MOLECULAR FORMULA
    C26H35ClN4O5
    CROSS REFERENCES
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    canSAR1087941

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 518.23
    AlogP 1.47
    HBond donors 3
    HBond acceptors 9
    Atoms 71
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087941.