canSAR1932738
FEATURES
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NAMES
    SMILES
    CCOC(=O)[C@@H](Cc1cc2ccnc(N)c2cc1OC)N1CC[C@H](NS(=O)(=O)c2cnc(N(C)C)c(C)c2)C1=O
    InChI
    InChI=1S/C27H34N6O6S/c1-6-39-27(35)22(13-18-12-17-7-9-29-24(28)20(17)14-23(18)38-5)33-10-8-21(26(33)34)31-40(36,37)19-11-16(2)25(30-15-19)32(3)4/h7,9,11-12,14-15,21-22,31H,6,8,10,13H2,1-5H3,(H2,28,29)/t21-,22+/m0/s1
    MOLECULAR FORMULA
    C27H34N6O6S
    CROSS REFERENCES
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    canSAR1932738
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight570.23
    AlogP1.65
    HBond donors3
    HBond acceptors12
    Atoms74
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932738.