835305 logo
canSAR835305
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCN(CC)C(=O)OCC(C[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3)C[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3
    InChI
    InChI=1S/C39H63NO10/c1-9-40(10-2)35(41)42-21-26(19-31-24(5)29-13-11-22(3)27-15-17-36(7)45-33(43-31)38(27,29)49-47-36)20-32-25(6)30-14-12-23(4)28-16-18-37(8)46-34(44-32)39(28,30)50-48-37/h22-34H,9-21H2,1-8H3/t22-,23-,24-,25-,27+,28+,29+,30+,31-,32-,33-,34-,36+,37+,38-,39-/m1/s1
    MOLECULAR FORMULA
    C39H63NO10
    CROSS REFERENCES
    835305 logo

    canSAR835305

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 705.45
    AlogP 7.36
    HBond donors 0
    HBond acceptors 11
    Atoms 113
    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 canSAR835305.