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canSAR1059489
FEATURES
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NAMES
    SMILES
    CC(=O)OC[C@H]1C[C@@H](C)[C@H]2[C@H](O1)[C@H](O)[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@H]5CN(C(=O)CC6CC6)CCO5)CC[C@@]45C[C@@]35CC[C@]21C
    InChI
    InChI=1S/C38H59NO7/c1-22-17-25(20-44-23(2)40)45-32-31(22)35(5)13-14-38-21-37(38)12-11-28(34(3,4)26(37)9-10-27(38)36(35,6)33(32)42)46-30-19-39(15-16-43-30)29(41)18-24-7-8-24/h22,24-28,30-33,42H,7-21H2,1-6H3/t22-,25-,26+,27+,28+,30+,31+,32+,33+,35-,36-,37-,38+/m1/s1
    MOLECULAR FORMULA
    C38H59NO7
    CROSS REFERENCES
    1059489 logo

    canSAR1059489

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 641.43
    AlogP 5.73
    HBond donors 1
    HBond acceptors 8
    Atoms 105
    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 canSAR1059489.