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canSAR387299
FEATURES
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NAMES
    SMILES
    C[C@H](CCn1oc(=O)[nH]c1=O)C1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC[C@@H](O)CC1C[C@H]3O
    InChI
    InChI=1S/C25H40N2O5/c1-14(8-11-27-22(30)26-23(31)32-27)17-4-5-18-21-19(7-10-25(17,18)3)24(2)9-6-16(28)12-15(24)13-20(21)29/h14-21,28-29H,4-13H2,1-3H3,(H,26,30,31)/t14-,15?,16-,17?,18?,19?,20-,21?,24+,25-/m1/s1
    MOLECULAR FORMULA
    C25H40N2O5
    CROSS REFERENCES
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    canSAR387299

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.29
    AlogP 3.15
    HBond donors 3
    HBond acceptors 7
    Atoms 72
    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 canSAR387299.