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canSAR828886
FEATURES
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NAMES
    SMILES
    CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4[C@H](C)CCCC(C)C)[C@@H]3C[C@@H](NCCc3c[nH]cn3)[C@@]2(O)C1
    InChI
    InChI=1S/C34H57N3O3/c1-22(2)8-7-9-23(3)28-10-11-29-27-18-31(36-17-14-25-20-35-21-37-25)34(39)19-26(40-24(4)38)12-16-33(34,6)30(27)13-15-32(28,29)5/h20-23,26-31,36,39H,7-19H2,1-6H3,(H,35,37)/t23-,26+,27+,28-,29+,30+,31-,32-,33-,34+/m1/s1
    MOLECULAR FORMULA
    C34H57N3O3
    CROSS REFERENCES
    828886 logo

    canSAR828886

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 555.44
    AlogP 6.69
    HBond donors 3
    HBond acceptors 6
    Atoms 97
    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 canSAR828886.