1014642 logo
canSAR1014642
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCNCCc1ccc(Cl)c(CN(C(=O)[C@H]2CNCC(=O)N2c2cnc(OCCCOCc3ccccc3OC)nc2)C2CC2)c1
    InChI
    InChI=1S/C34H43ClN6O5/c1-3-36-14-13-24-9-12-29(35)26(17-24)22-40(27-10-11-27)33(43)30-20-37-21-32(42)41(30)28-18-38-34(39-19-28)46-16-6-15-45-23-25-7-4-5-8-31(25)44-2/h4-5,7-9,12,17-19,27,30,36-37H,3,6,10-11,13-16,20-23H2,1-2H3/t30-/m1/s1
    MOLECULAR FORMULA
    C34H43ClN6O5
    CROSS REFERENCES
    1014642 logo

    canSAR1014642

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 650.30
    AlogP 3.77
    HBond donors 2
    HBond acceptors 11
    Atoms 89
    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 canSAR1014642.