canSAR1005433
FEATURES
Loading...
NAMES
    SMILES
    CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.[BH3-]P(=O)(OP(=O)([O-])OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O)OP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C18H28BN4O22P4.4C12H27N/c19-46(32,43-47(33,34)39-5-7-11(26)13(28)15(41-7)22-3-1-9(24)20-17(22)30)44-49(37,38)45-48(35,36)40-6-8-12(27)14(29)16(42-8)23-4-2-10(25)21-18(23)31;4*1-4-7-10-13(11-8-5-2)12-9-6-3/h1-4,7-8,11-16,26-29H,5-6H2,19H3,(H,33,34)(H,35,36)(H,37,38)(H,20,24,30)(H,21,25,31);4*4-12H2,1-3H3/q-1;;;;/p+1/t7-,8-,11-,12-,13-,14-,15-,16-,46?;;;;/m1..../s1
    MOLECULAR FORMULA
    C66H137BN8O22P4
    CROSS REFERENCES
    Loading...
    canSAR1005433
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1528.89
    AlogP2.37
    HBond donors10
    HBond acceptors30
    Atoms238
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1005433.