canSAR2096156
FEATURES
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NAMES
    SMILES
    N=C(N)NCCCCC(NC(=O)C(CCCCNC(=N)N)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCN)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCCNC(=N)N)NC(=O)C(N)CCN)C(N)=O
    InChI
    InChI=1S/C73H101N25O9/c74-28-26-49(76)63(100)92-55(24-10-13-31-85-72(80)81)65(102)95-60(35-43-39-89-52-21-7-3-17-47(43)52)69(106)98-59(34-42-38-88-51-20-6-2-16-46(42)51)68(105)94-57(27-29-75)66(103)96-61(36-44-40-90-53-22-8-4-18-48(44)53)70(107)97-58(33-41-37-87-50-19-5-1-15-45(41)50)67(104)93-56(25-11-14-32-86-73(82)83)64(101)91-54(62(77)99)23-9-12-30-84-71(78)79/h1-8,15-22,37-40,49,54-61,87-90H,9-14,23-36,74-76H2,(H2,77,99)(H,91,101)(H,92,100)(H,93,104)(H,94,105)(H,95,102)(H,96,103)(H,97,107)(H,98,106)(H4,78,79,84)(H4,80,81,85)(H4,82,83,86)/t49-,54-,55-,56-,57-,58-,59-,60-,61-/m0/s1
    MOLECULAR FORMULA
    C73H101N25O9
    CROSS REFERENCES
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    canSAR2096156
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1471.82
    AlogP-0.77
    HBond donors32
    HBond acceptors34
    Atoms208
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096156.