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canSAR1155510
FEATURES
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NAMES
    SMILES
    COC(/C=C(\C1=NCCN1Cc1ccc(Cl)nc1)[N+](=O)[O-])/C(=C1\NCCN1Cc1ccc(Cl)nc1)[N+](=O)[O-]
    InChI
    InChI=1S/C23H24Cl2N8O5/c1-38-18(21(33(36)37)23-27-7-9-31(23)14-16-3-5-20(25)29-12-16)10-17(32(34)35)22-26-6-8-30(22)13-15-2-4-19(24)28-11-15/h2-5,10-12,18,27H,6-9,13-14H2,1H3/b17-10+,23-21-
    MOLECULAR FORMULA
    C23H24Cl2N8O5
    CROSS REFERENCES
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    canSAR1155510

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 562.12
    AlogP 2.72
    HBond donors 1
    HBond acceptors 13
    Atoms 62
    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 canSAR1155510.