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canSAR561975
FEATURES
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NAMES
    SMILES
    CC(C)c1c(C(=O)N2CCCC2c2ccccc2)nn(-c2ccc(F)cc2)c1CC[C@@H](O)C[C@@H](O)CC(=O)[O-].[Na+]
    InChI
    InChI=1S/C30H36FN3O5.Na/c1-19(2)28-26(15-14-23(35)17-24(36)18-27(37)38)34(22-12-10-21(31)11-13-22)32-29(28)30(39)33-16-6-9-25(33)20-7-4-3-5-8-20;/h3-5,7-8,10-13,19,23-25,35-36H,6,9,14-18H2,1-2H3,(H,37,38);/q;+1/p-1/t23-,24-,25?;/m1./s1
    MOLECULAR FORMULA
    C30H35FN3NaO5
    CROSS REFERENCES
    561975 logo

    canSAR561975

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 559.25
    AlogP 0.30
    HBond donors 2
    HBond acceptors 8
    Atoms 75
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR561975.