1511497 logo
canSAR1511497
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1c(N(Cc2cc3c(Cl)cccc3n2C)S(=O)(=O)c2ccc(C(=O)[O-])cc2)ncc2ccccc12.[Na+]
    InChI
    InChI=1S/C27H22ClN3O4S.Na/c1-17-22-7-4-3-6-19(22)15-29-26(17)31(36(34,35)21-12-10-18(11-13-21)27(32)33)16-20-14-23-24(28)8-5-9-25(23)30(20)2;/h3-15H,16H2,1-2H3,(H,32,33);/q;+1/p-1
    MOLECULAR FORMULA
    C27H21ClN3NaO4S
    CROSS REFERENCES
    1511497 logo

    canSAR1511497

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 541.08
    AlogP 1.45
    HBond donors 0
    HBond acceptors 7
    Atoms 58
    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 canSAR1511497.