canSAR1417300
FEATURES
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NAMES
    SMILES
    CC(C)N(C(=O)[C@H]1C[C@H](CC(=O)NCCN2CCOCC2)C(=O)N2CCc3c([nH]c4cc(CCC(=O)N(C)C)ccc34)[C@]12C)C(C)C
    InChI
    InChI=1S/C36H54N6O5/c1-23(2)42(24(3)4)35(46)29-21-26(22-31(43)37-13-15-40-16-18-47-19-17-40)34(45)41-14-12-28-27-10-8-25(9-11-32(44)39(6)7)20-30(27)38-33(28)36(29,41)5/h8,10,20,23-24,26,29,38H,9,11-19,21-22H2,1-7H3,(H,37,43)/t26-,29-,36+/m1/s1
    MOLECULAR FORMULA
    C36H54N6O5
    CROSS REFERENCES
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    canSAR1417300
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight650.42
    AlogP2.91
    HBond donors2
    HBond acceptors11
    Atoms101
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417300.