344501 logo
canSAR344501
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C1C2Oc3c(O)ccc4c3C23CCN(CC2CC2)C(C4)[C@]3(O)CC12Cc1cc3ccccc3cc1C2
    InChI
    InChI=1S/C32H31NO4/c34-24-8-7-21-13-25-32(36)17-30(14-22-11-19-3-1-2-4-20(19)12-23(22)15-30)28(35)29-31(32,26(21)27(24)37-29)9-10-33(25)16-18-5-6-18/h1-4,7-8,11-12,18,25,29,34,36H,5-6,9-10,13-17H2/t25?,29?,31?,32-/m1/s1
    MOLECULAR FORMULA
    C32H31NO4
    CROSS REFERENCES
    344501 logo

    canSAR344501

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 493.23
    AlogP 4.07
    HBond donors 2
    HBond acceptors 5
    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 canSAR344501.