canSAR1773864
FEATURES
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NAMES
    SMILES
    Cc1cccc(N2CC(C(=O)Nc3nnc(SCC(=O)NCC4CCCO4)s3)CC2=O)c1
    InChI
    InChI=1S/C21H25N5O4S2/c1-13-4-2-5-15(8-13)26-11-14(9-18(26)28)19(29)23-20-24-25-21(32-20)31-12-17(27)22-10-16-6-3-7-30-16/h2,4-5,8,14,16H,3,6-7,9-12H2,1H3,(H,22,27)(H,23,24,29)
    MOLECULAR FORMULA
    C21H25N5O4S2
    CROSS REFERENCES
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    canSAR1773864
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight475.13
    AlogP2.23
    HBond donors2
    HBond acceptors9
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1773864.