canSAR1746727
FEATURES
Loading...
NAMES
    SMILES
    CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)NC(CCC(=O)NC(P(=O)([O-])O)P(=O)(O)O)C(=O)O)cc1.[Na+]
    InChI
    InChI=1S/C21H27N9O10P2.Na/c1-30(9-11-8-24-17-15(25-11)16(22)28-20(23)29-17)12-4-2-10(3-5-12)18(32)26-13(19(33)34)6-7-14(31)27-21(41(35,36)37)42(38,39)40;/h2-5,8,13,21H,6-7,9H2,1H3,(H,26,32)(H,27,31)(H,33,34)(H2,35,36,37)(H2,38,39,40)(H4,22,23,24,28,29);/q;+1/p-1
    MOLECULAR FORMULA
    C21H26N9NaO10P2
    CROSS REFERENCES
    Loading...
    canSAR1746727
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight649.12
    AlogP-4.69
    HBond donors10
    HBond acceptors19
    Atoms69
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746727.