canSAR816547
FEATURES
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NAMES
    SMILES
    C=C[C@]12OC(=O)N(CCCCn3cc(Cl)c4ncccc43)[C@@H]1[C@@H](C)C(=O)[C@H](C)C[C@@](C)(OC)[C@H](O[C@@H]1O[C@H](C)C[C@H](N(C)C)[C@H]1O)[C@@H](C)C(=O)[C@@H](C)C(=O)O[C@@H]2CC
    InChI
    InChI=1S/C43H63ClN4O10/c1-12-32-43(13-2)37(48(41(53)58-43)20-15-14-19-47-23-29(44)33-30(47)17-16-18-45-33)26(5)34(49)24(3)22-42(8,54-11)38(27(6)35(50)28(7)39(52)56-32)57-40-36(51)31(46(9)10)21-25(4)55-40/h13,16-18,23-28,31-32,36-38,40,51H,2,12,14-15,19-22H2,1,3-11H3/t24-,25-,26+,27+,28-,31+,32-,36-,37-,38-,40+,42-,43-/m1/s1
    MOLECULAR FORMULA
    C43H63ClN4O10
    CROSS REFERENCES
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    canSAR816547
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight830.42
    AlogP5.84
    HBond donors1
    HBond acceptors14
    Atoms121
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR816547.