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canSAR1094588
FEATURES
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NAMES
    SMILES
    O=C1O[C@@H](CO)[C@@H]2COc3cc(-c4ccc(N5CCC(O)CC5)nc4)ccc3N12
    InChI
    InChI=1S/C21H23N3O5/c25-11-19-17-12-28-18-9-13(1-3-16(18)24(17)21(27)29-19)14-2-4-20(22-10-14)23-7-5-15(26)6-8-23/h1-4,9-10,15,17,19,25-26H,5-8,11-12H2/t17-,19-/m0/s1
    MOLECULAR FORMULA
    C21H23N3O5
    CROSS REFERENCES
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    canSAR1094588

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.16
    AlogP 1.79
    HBond donors 2
    HBond acceptors 8
    Atoms 52
    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 canSAR1094588.