1132355 logo
canSAR1132355
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(C)C)C(=O)NCC(N)=O
    InChI
    InChI=1S/C43H64N8O14/c1-20(2)31(40(61)46-18-30(45)54)49-41(62)32(21(3)4)50-42(63)33(23(6)64-43-36(57)35(56)34(55)29(19-52)65-43)51-39(60)28(17-24-10-8-7-9-11-24)48-37(58)22(5)47-38(59)27(44)16-25-12-14-26(53)15-13-25/h7-15,20-23,27-29,31-36,43,52-53,55-57H,16-19,44H2,1-6H3,(H2,45,54)(H,46,61)(H,47,59)(H,48,58)(H,49,62)(H,50,63)(H,51,60)/t22-,23-,27+,28+,29-,31+,32+,33+,34-,35-,36-,43+/m1/s1
    MOLECULAR FORMULA
    C43H64N8O14
    CROSS REFERENCES
    1132355 logo

    canSAR1132355

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 916.45
    AlogP -3.93
    HBond donors 15
    HBond acceptors 22
    Atoms 129
    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 canSAR1132355.