926401 logo
canSAR926401
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)[C@@H]1C[C@H](OC(=O)[C@@H](N)C(C)C)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
    InChI
    InChI=1S/C26H35NO8/c1-13(2)19(27)24(31)34-17-10-16(22(29)32-5)25(3)8-6-15-23(30)35-18(14-7-9-33-12-14)11-26(15,4)21(25)20(17)28/h7,9,12-13,15-19,21H,6,8,10-11,27H2,1-5H3/t15-,16-,17-,18-,19-,21-,25-,26-/m0/s1
    MOLECULAR FORMULA
    C26H35NO8
    CROSS REFERENCES
    926401 logo

    canSAR926401

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 489.24
    AlogP 2.96
    HBond donors 2
    HBond acceptors 9
    Atoms 70
    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 canSAR926401.