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canSAR991911
FEATURES
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NAMES
    SMILES
    CC[C@@H](C)[C@H](NC(=O)[C@@H](CC(O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)COc1ccccc1)C(C)C)C(=O)N(C)c1ccccn1
    InChI
    InChI=1S/C38H55N7O6/c1-8-26(6)35(38(50)45(7)33-16-12-13-17-40-33)44-36(48)29(25(4)5)20-32(46)30(18-24(2)3)43-37(49)31(19-27-21-39-23-41-27)42-34(47)22-51-28-14-10-9-11-15-28/h9-17,21,23-26,29-32,35,46H,8,18-20,22H2,1-7H3,(H,39,41)(H,42,47)(H,43,49)(H,44,48)/t26-,29+,30+,31+,32?,35+/m1/s1
    MOLECULAR FORMULA
    C38H55N7O6
    CROSS REFERENCES
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    canSAR991911

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 705.42
    AlogP 3.66
    HBond donors 5
    HBond acceptors 13
    Atoms 106
    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 canSAR991911.