canSAR741302
FEATURES
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NAMES
    SMILES
    O=C(O)COCCCCN(c1cnc(-c2ccccc2)c(-c2ccccc2)n1)C1CCCC1
    InChI
    InChI=1S/C27H31N3O3/c31-25(32)20-33-18-10-9-17-30(23-15-7-8-16-23)24-19-28-26(21-11-3-1-4-12-21)27(29-24)22-13-5-2-6-14-22/h1-6,11-14,19,23H,7-10,15-18,20H2,(H,31,32)
    MOLECULAR FORMULA
    C27H31N3O3
    CROSS REFERENCES
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    canSAR741302
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight445.24
    AlogP5.44
    HBond donors1
    HBond acceptors6
    Atoms64
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR741302.