canSAR1835949
FEATURES
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NAMES
    SMILES
    COCCNC(=O)[C@@H]1CC[C@@H](NC(=O)c2ccc3[nH]nc(-c4ccnc(C)c4)c3c2)CN1Cc1c(F)cccc1OC
    InChI
    InChI=1S/C31H35FN6O4/c1-19-15-20(11-12-33-19)29-23-16-21(7-9-26(23)36-37-29)30(39)35-22-8-10-27(31(40)34-13-14-41-2)38(17-22)18-24-25(32)5-4-6-28(24)42-3/h4-7,9,11-12,15-16,22,27H,8,10,13-14,17-18H2,1-3H3,(H,34,40)(H,35,39)(H,36,37)/t22-,27+/m1/s1
    MOLECULAR FORMULA
    C31H35FN6O4
    CROSS REFERENCES
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    canSAR1835949
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight574.27
    AlogP3.61
    HBond donors3
    HBond acceptors10
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1835949.