127147 logo
canSAR127147
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NCC1CCCCC1)N1CCN(C(c2ccc(Cl)cc2)c2ccccc2Cl)CC1
    InChI
    InChI=1S/C25H31Cl2N3O/c26-21-12-10-20(11-13-21)24(22-8-4-5-9-23(22)27)29-14-16-30(17-15-29)25(31)28-18-19-6-2-1-3-7-19/h4-5,8-13,19,24H,1-3,6-7,14-18H2,(H,28,31)
    MOLECULAR FORMULA
    C25H31Cl2N3O
    CROSS REFERENCES
    127147 logo

    canSAR127147

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.18
    AlogP 5.99
    HBond donors 1
    HBond acceptors 4
    Atoms 62
    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 canSAR127147.