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canSAR644693
FEATURES
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NAMES
    SMILES
    O=C(Nc1cc(C(=O)Nc2cccc(S(=O)(=O)O)c2)cc(C(=O)Nc2cccc(S(=O)(=O)O)c2)c1)c1cccc(C(=O)Nc2cc(C(=O)Nc3cccc(S(=O)(=O)O)c3)cc(C(=O)Nc3cccc(S(=O)(=O)O)c3)c2)c1
    InChI
    InChI=1S/C48H36N6O18S4/c55-43(53-37-19-29(45(57)49-33-8-2-12-39(23-33)73(61,62)63)17-30(20-37)46(58)50-34-9-3-13-40(24-34)74(64,65)66)27-6-1-7-28(16-27)44(56)54-38-21-31(47(59)51-35-10-4-14-41(25-35)75(67,68)69)18-32(22-38)48(60)52-36-11-5-15-42(26-36)76(70,71)72/h1-26H,(H,49,57)(H,50,58)(H,51,59)(H,52,60)(H,53,55)(H,54,56)(H,61,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)
    MOLECULAR FORMULA
    C48H36N6O18S4
    CROSS REFERENCES
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    canSAR644693

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1112.10
    AlogP 6.19
    HBond donors 10
    HBond acceptors 24
    Atoms 112
    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 canSAR644693.