1864824 logo
canSAR1864824
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOC(=O)[C@]12Cc3c(cc(OC)c(OC)c3OC)[C@H]1N(CCC(=O)OC)C(=O)c1cc(OC)ccc12
    InChI
    InChI=1S/C27H31NO9/c1-7-37-26(31)27-14-18-16(13-20(33-3)23(36-6)22(18)35-5)24(27)28(11-10-21(29)34-4)25(30)17-12-15(32-2)8-9-19(17)27/h8-9,12-13,24H,7,10-11,14H2,1-6H3/t24-,27+/m1/s1
    MOLECULAR FORMULA
    C27H31NO9
    CROSS REFERENCES
    1864824 logo

    canSAR1864824

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 513.20
    AlogP 2.84
    HBond donors 0
    HBond acceptors 10
    Atoms 68
    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 canSAR1864824.