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canSAR834534
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCNC(C)=S)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O
    InChI
    InChI=1S/C27H51N7O8S/c1-5-15(2)21(27(41)42)33-26(40)22(16(3)36)34-25(39)20(11-7-9-13-30-17(4)43)32-24(38)19(10-6-8-12-28)31-23(37)18(29)14-35/h15-16,18-22,35-36H,5-14,28-29H2,1-4H3,(H,30,43)(H,31,37)(H,32,38)(H,33,40)(H,34,39)(H,41,42)/t15-,16+,18-,19-,20-,21-,22-/m0/s1
    MOLECULAR FORMULA
    C27H51N7O8S
    CROSS REFERENCES
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    canSAR834534

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 633.35
    AlogP -2.01
    HBond donors 12
    HBond acceptors 15
    Atoms 94
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR834534.