1718847 logo
canSAR1718847
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@H](NC(=O)c1ccon1)c1ccc(OC2CCN(c3ccnc(OCC4CC4)c3)C2)cc1
    InChI
    InChI=1S/C25H28N4O4/c1-17(27-25(30)23-10-13-32-28-23)19-4-6-21(7-5-19)33-22-9-12-29(15-22)20-8-11-26-24(14-20)31-16-18-2-3-18/h4-8,10-11,13-14,17-18,22H,2-3,9,12,15-16H2,1H3,(H,27,30)/t17-,22?/m0/s1
    MOLECULAR FORMULA
    C25H28N4O4
    CROSS REFERENCES
    1718847 logo

    canSAR1718847

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.21
    AlogP 4.01
    HBond donors 1
    HBond acceptors 8
    Atoms 61
    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 canSAR1718847.