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canSAR1123858
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O
    InChI
    InChI=1S/C35H56N10O9/c1-18(2)12-24(30(49)41-23(10-7-11-40-35(38)39)29(48)44-26(34(53)54)15-28(37)47)42-31(50)25(13-19(3)4)43-32(51)27-14-20-8-5-6-9-21(20)16-45(27)33(52)22(36)17-46/h5-6,8-9,18-19,22-27,46H,7,10-17,36H2,1-4H3,(H2,37,47)(H,41,49)(H,42,50)(H,43,51)(H,44,48)(H,53,54)(H4,38,39,40)/t22-,23-,24-,25-,26-,27-/m0/s1
    MOLECULAR FORMULA
    C35H56N10O9
    CROSS REFERENCES
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    canSAR1123858

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 760.42
    AlogP -2.70
    HBond donors 14
    HBond acceptors 19
    Atoms 110
    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 canSAR1123858.