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canSAR2204316
FEATURES
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NAMES
    SMILES
    NC1(c2cc(C(=O)N[C@@H]3[C@H]4Oc5ccc(Oc6ccnc7c6CCC(=O)N7)cc5[C@@H]34)cc(C(F)(F)F)c2)CC1
    InChI
    InChI=1S/C28H23F3N4O4/c29-28(30,31)15-10-13(9-14(11-15)27(32)6-7-27)26(37)35-23-22-18-12-16(1-3-19(18)39-24(22)23)38-20-5-8-33-25-17(20)2-4-21(36)34-25/h1,3,5,8-12,22-24H,2,4,6-7,32H2,(H,35,37)(H,33,34,36)/t22-,23-,24-/m0/s1
    MOLECULAR FORMULA
    C28H23F3N4O4
    CROSS REFERENCES
    2204316 logo

    canSAR2204316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 536.17
    AlogP 4.38
    HBond donors 4
    HBond acceptors 8
    Atoms 62
    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 canSAR2204316.