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canSAR839684
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NAMES
    SMILES
    CC(C)n1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)NC3CCCC3)CN(C)[C@@H]1C2
    InChI
    InChI=1S/C24H33N3O/c1-15(2)27-14-16-12-22-20(19-9-6-10-21(27)23(16)19)11-17(13-26(22)3)24(28)25-18-7-4-5-8-18/h6,9-10,14-15,17-18,20,22H,4-5,7-8,11-13H2,1-3H3,(H,25,28)/t17-,20-,22-/m1/s1
    MOLECULAR FORMULA
    C24H33N3O
    CROSS REFERENCES
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    canSAR839684

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 379.26
    AlogP 4.24
    HBond donors 1
    HBond acceptors 4
    Atoms 61
    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 canSAR839684.