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canSAR1592102
FEATURES
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NAMES
    SMILES
    COc1cc(C)ccc1OCCCCN1CC(C)OC(C)C1.O=C(O)C(=O)O
    InChI
    InChI=1S/C18H29NO3.C2H2O4/c1-14-7-8-17(18(11-14)20-4)21-10-6-5-9-19-12-15(2)22-16(3)13-19;3-1(4)2(5)6/h7-8,11,15-16H,5-6,9-10,12-13H2,1-4H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C20H31NO7
    CROSS REFERENCES
    1592102 logo

    canSAR1592102

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.21
    AlogP 2.43
    HBond donors 2
    HBond acceptors 8
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1592102.