canSAR734050
FEATURES
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NAMES
    SMILES
    NCCC[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O
    InChI
    InChI=1S/C51H74N14O10S2/c52-22-10-17-34-44(70)63-37(27-40(53)66)47(73)64-38(49(75)65-24-12-19-39(65)48(74)61-33(18-11-23-57-50(55)56)43(69)58-29-41(54)67)30-76-77-51(20-8-3-9-21-51)28-42(68)59-35(25-31-13-4-1-5-14-31)45(71)62-36(46(72)60-34)26-32-15-6-2-7-16-32/h1-2,4-7,13-16,33-39H,3,8-12,17-30,52H2,(H2,53,66)(H2,54,67)(H,58,69)(H,59,68)(H,60,72)(H,61,74)(H,62,71)(H,63,70)(H,64,73)(H4,55,56,57)/t33-,34-,35+,36+,37+,38+,39+/m1/s1
    MOLECULAR FORMULA
    C51H74N14O10S2
    CROSS REFERENCES
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    canSAR734050
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1106.52
    AlogP-1.87
    HBond donors17
    HBond acceptors24
    Atoms151
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR734050.