canSAR385933
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(C)(C)N(C)C
    InChI
    InChI=1S/C29H36N6O3/c1-18(36)32-26(15-20-17-31-24-13-9-7-11-22(20)24)34-27(37)25(33-28(38)29(2,3)35(4)5)14-19-16-30-23-12-8-6-10-21(19)23/h6-13,16-17,25-26,30-31H,14-15H2,1-5H3,(H,32,36)(H,33,38)(H,34,37)/t25-,26-/m1/s1
    MOLECULAR FORMULA
    C29H36N6O3
    CROSS REFERENCES
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    canSAR385933
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight516.28
    AlogP2.84
    HBond donors5
    HBond acceptors9
    Atoms74
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR385933.