838645 logo
canSAR838645
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C3[C@H](CCC[C@@H]3N(C)C)[C@H]12
    InChI
    InChI=1S/C15H22N2O4/c1-7(18)10-12-8-5-4-6-9(16(2)3)11(8)13(15(20)21)17(12)14(10)19/h7-10,12,18H,4-6H2,1-3H3,(H,20,21)/t7-,8+,9+,10-,12-/m1/s1
    MOLECULAR FORMULA
    C15H22N2O4
    CROSS REFERENCES
    838645 logo

    canSAR838645

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 294.16
    AlogP 0.28
    HBond donors 2
    HBond acceptors 6
    Atoms 43
    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 canSAR838645.