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canSAR988412
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NAMES
    SMILES
    CC(=O)Nc1cn(C)c(C(=O)Nc2cn(C)c(C(=O)Nc3cc(C(=O)Nc4cc(C(=O)NCCCC(=O)Nc5cn(C)c(C(=O)Nc6cn(C)c(C(=O)Nc7ccc8[nH]c(C(=O)N9CC(CCl)c%10c9cc(O)c9ccccc%109)cc8c7)n6)n5)n(C)c4)n(C)c3)n2)n1
    InChI
    InChI=1S/C60H59ClN20O10/c1-30(82)63-44-26-77(4)52(69-44)58(89)73-47-29-80(7)51(72-47)57(88)66-35-20-42(76(3)25-35)55(86)65-34-19-41(75(2)24-34)54(85)62-16-10-13-48(84)68-45-27-78(5)53(70-45)59(90)74-46-28-79(6)50(71-46)56(87)64-33-14-15-38-31(17-33)18-39(67-38)60(91)81-23-32(22-61)49-37-12-9-8-11-36(37)43(83)21-40(49)81/h8-9,11-12,14-15,17-21,24-29,32,67,83H,10,13,16,22-23H2,1-7H3,(H,62,85)(H,63,82)(H,64,87)(H,65,86)(H,66,88)(H,68,84)(H,73,89)(H,74,90)
    MOLECULAR FORMULA
    C60H59ClN20O10
    CROSS REFERENCES
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    canSAR988412

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1254.44
    AlogP 5.99
    HBond donors 10
    HBond acceptors 30
    Atoms 150
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR988412.