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canSAR1141915
FEATURES
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NAMES
    SMILES
    CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](OC(=O)N(CCO)CCO)CC1=C[C@@H]3O
    InChI
    InChI=1S/C32H55NO5/c1-21(2)7-6-8-22(3)25-9-10-26-29-27(12-14-32(25,26)5)31(4)13-11-24(19-23(31)20-28(29)36)38-30(37)33(15-17-34)16-18-35/h20-22,24-29,34-36H,6-19H2,1-5H3/t22-,24+,25-,26+,27+,28+,29+,31+,32-/m1/s1
    MOLECULAR FORMULA
    C32H55NO5
    CROSS REFERENCES
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    canSAR1141915

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 533.41
    AlogP 5.79
    HBond donors 3
    HBond acceptors 6
    Atoms 93
    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 canSAR1141915.