986133 logo
canSAR986133
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COCCCc1ccc(Cl)c(CN(C(=O)[C@H]2CNCC[C@@H]2c2ccn(C)c(=O)c2)C2CC2)c1
    InChI
    InChI=1S/C26H34ClN3O3/c1-29-12-10-19(15-25(29)31)22-9-11-28-16-23(22)26(32)30(21-6-7-21)17-20-14-18(4-3-13-33-2)5-8-24(20)27/h5,8,10,12,14-15,21-23,28H,3-4,6-7,9,11,13,16-17H2,1-2H3/t22-,23+/m1/s1
    MOLECULAR FORMULA
    C26H34ClN3O3
    CROSS REFERENCES
    986133 logo

    canSAR986133

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.23
    AlogP 3.50
    HBond donors 1
    HBond acceptors 6
    Atoms 67
    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 canSAR986133.