canSAR1584550
FEATURES
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NAMES
    SMILES
    c1ccc2c(c1)nc(C1CCCN1)n2[C@@H]1C[C@@H]2CCC[C@H](C1)N2[C@H]1C[C@H]2CCCC[C@H](C2)C1
    InChI
    InChI=1S/C29H42N4/c1-2-8-21-15-20(7-1)16-24(17-21)32-22-9-5-10-23(32)19-25(18-22)33-28-13-4-3-11-26(28)31-29(33)27-12-6-14-30-27/h3-4,11,13,20-25,27,30H,1-2,5-10,12,14-19H2/t20-,21+,22-,23+,24-,25+,27?
    MOLECULAR FORMULA
    C29H42N4
    CROSS REFERENCES
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    canSAR1584550
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight446.34
    AlogP6.38
    HBond donors1
    HBond acceptors4
    Atoms75
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1584550.