canSAR824909
FEATURES
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NAMES
    SMILES
    CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)[C@@H](C)O)C(=O)N[C@H]1C[C@H]2CCC[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O
    InChI
    InChI=1S/C62H84N12O14/c1-33(2)49(70-56(82)44(32-48(76)77)68-60(86)51(36(6)75)72-57(83)46-26-17-27-73(46)62(88)50(34(3)4)71-54(80)41(63)28-37-18-10-7-11-19-37)59(85)69-45-31-40-24-16-25-47(74(40)61(45)87)58(84)67-43(30-39-22-14-9-15-23-39)55(81)65-35(5)53(79)66-42(52(64)78)29-38-20-12-8-13-21-38/h7-15,18-23,33-36,40-47,49-51,75H,16-17,24-32,63H2,1-6H3,(H2,64,78)(H,65,81)(H,66,79)(H,67,84)(H,68,86)(H,69,85)(H,70,82)(H,71,80)(H,72,83)(H,76,77)/t35-,36+,40+,41-,42-,43-,44-,45-,46-,47-,49-,50-,51-/m0/s1
    MOLECULAR FORMULA
    C62H84N12O14
    CROSS REFERENCES
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    canSAR824909
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1220.62
    AlogP-1.26
    HBond donors14
    HBond acceptors26
    Atoms172
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824909.