2091731 logo
canSAR2091731
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)n1nc(-c2cnc(N)c(Cl)c2)cc1[C@@H]1[C@H]2CN(C3COC3)C[C@H]21
    InChI
    InChI=1S/C19H24ClN5O/c1-10(2)25-17(4-16(23-25)11-3-15(20)19(21)22-5-11)18-13-6-24(7-14(13)18)12-8-26-9-12/h3-5,10,12-14,18H,6-9H2,1-2H3,(H2,21,22)/t13-,14+,18+
    MOLECULAR FORMULA
    C19H24ClN5O
    CROSS REFERENCES
    2091731 logo

    canSAR2091731

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 373.17
    AlogP 2.81
    HBond donors 2
    HBond acceptors 6
    Atoms 50
    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 canSAR2091731.