1620687 logo
canSAR1620687
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cc(CNC(=O)c2cnc(Oc3ccc4c(c3)CCC(c3ccccc3)O4)s2)ccn1
    InChI
    InChI=1S/C26H23N3O3S/c1-17-13-18(11-12-27-17)15-28-25(30)24-16-29-26(33-24)31-21-8-10-23-20(14-21)7-9-22(32-23)19-5-3-2-4-6-19/h2-6,8,10-14,16,22H,7,9,15H2,1H3,(H,28,30)
    MOLECULAR FORMULA
    C26H23N3O3S
    CROSS REFERENCES
    1620687 logo

    canSAR1620687

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.15
    AlogP 5.64
    HBond donors 1
    HBond acceptors 6
    Atoms 56
    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 canSAR1620687.