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canSAR65157
FEATURES
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NAMES
    SMILES
    N=C(N)N[C@@H](C(=O)NCC(=O)N1CCC(c2cc(-c3ccc(O)cc3Cl)[nH]n2)CC1)C1CCCCC1
    InChI
    InChI=1S/C25H34ClN7O3/c26-19-12-17(34)6-7-18(19)21-13-20(31-32-21)15-8-10-33(11-9-15)22(35)14-29-24(36)23(30-25(27)28)16-4-2-1-3-5-16/h6-7,12-13,15-16,23,34H,1-5,8-11,14H2,(H,29,36)(H,31,32)(H4,27,28,30)/t23-/m1/s1
    MOLECULAR FORMULA
    C25H34ClN7O3
    CROSS REFERENCES
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    canSAR65157

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 515.24
    AlogP 2.69
    HBond donors 7
    HBond acceptors 10
    Atoms 70
    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 canSAR65157.