34265 logo
canSAR34265
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCN1C(C(=O)N[C@@H](Cc2ccccc2)C(=O)C(=O)NCc2ccccn2)Cc2cc3c(cc2S1(=O)=O)OCCO3
    InChI
    InChI=1S/C29H30N4O7S/c1-2-33-23(15-20-16-24-25(40-13-12-39-24)17-26(20)41(33,37)38)28(35)32-22(14-19-8-4-3-5-9-19)27(34)29(36)31-18-21-10-6-7-11-30-21/h3-11,16-17,22-23H,2,12-15,18H2,1H3,(H,31,36)(H,32,35)/t22-,23?/m0/s1
    MOLECULAR FORMULA
    C29H30N4O7S
    CROSS REFERENCES
    34265 logo

    canSAR34265

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 578.18
    AlogP 1.40
    HBond donors 2
    HBond acceptors 11
    Atoms 71
    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 canSAR34265.