561003 logo
canSAR561003
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    c1cc(CNCCN2CCNCC2)cc(-c2ccc(-c3nc4ccccc4[nH]3)cc2)c1
    InChI
    InChI=1S/C26H29N5/c1-2-7-25-24(6-1)29-26(30-25)22-10-8-21(9-11-22)23-5-3-4-20(18-23)19-28-14-17-31-15-12-27-13-16-31/h1-11,18,27-28H,12-17,19H2,(H,29,30)
    MOLECULAR FORMULA
    C26H29N5
    CROSS REFERENCES
    561003 logo

    canSAR561003

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.24
    AlogP 3.89
    HBond donors 3
    HBond acceptors 5
    Atoms 60
    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 canSAR561003.