1511400 logo
canSAR1511400
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=S(=O)(O)c1cccc2ccc(O)c(/N=N\c3ccc(S(=O)(=O)c4ccc(/N=N/c5c(O)ccc6cccc(S(=O)(=O)O)c56)cc4)cc3)c12
    InChI
    InChI=1S/C32H22N4O10S3/c37-25-17-7-19-3-1-5-27(48(41,42)43)29(19)31(25)35-33-21-9-13-23(14-10-21)47(39,40)24-15-11-22(12-16-24)34-36-32-26(38)18-8-20-4-2-6-28(30(20)32)49(44,45)46/h1-18,37-38H,(H,41,42,43)(H,44,45,46)/b35-33-,36-34+
    MOLECULAR FORMULA
    C32H22N4O10S3
    CROSS REFERENCES
    1511400 logo

    canSAR1511400

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 718.05
    AlogP 7.56
    HBond donors 4
    HBond acceptors 14
    Atoms 71
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1511400.