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canSAR835240
FEATURES
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NAMES
    SMILES
    CN1C[C@H](C(=O)N2CCN(c3ccc4nsnc4n3)CC2)C[C@@H]2Cc3c(cccc3OCc3ccccc3)C[C@H]21
    InChI
    InChI=1S/C31H34N6O2S/c1-35-19-24(31(38)37-14-12-36(13-15-37)29-11-10-26-30(32-29)34-40-33-26)16-23-17-25-22(18-27(23)35)8-5-9-28(25)39-20-21-6-3-2-4-7-21/h2-11,23-24,27H,12-20H2,1H3/t23-,24-,27-/m1/s1
    MOLECULAR FORMULA
    C31H34N6O2S
    CROSS REFERENCES
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    canSAR835240

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 554.25
    AlogP 4.05
    HBond donors 0
    HBond acceptors 8
    Atoms 74
    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 canSAR835240.