canSAR855525
FEATURES
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NAMES
    SMILES
    C=C1CC[C@H](OC(=O)NCCN(C)C)C/C1=C/C=C1\CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)/C=C/[C@H](C)C(C)C.Cl
    InChI
    InChI=1S/C33H54N2O2.ClH/c1-23(2)24(3)11-12-26(5)30-17-18-31-27(10-9-19-33(30,31)6)14-15-28-22-29(16-13-25(28)4)37-32(36)34-20-21-35(7)8;/h11-12,14-15,23-24,26,29-31H,4,9-10,13,16-22H2,1-3,5-8H3,(H,34,36);1H/b12-11+,27-14+,28-15-;/t24-,26+,29-,30+,31-,33+;/m0./s1
    MOLECULAR FORMULA
    C33H55ClN2O2
    CROSS REFERENCES
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    canSAR855525
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight546.40
    AlogP8.36
    HBond donors1
    HBond acceptors4
    Atoms93
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR855525.