canSAR1083146
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(C)C)C(=O)O
    InChI
    InChI=1S/C84H154N30O19/c1-11-47(7)65(77(128)100-44-63(117)103-52(27-19-37-96-82(90)91)71(122)101-49(9)67(118)105-53(25-14-17-35-86)73(124)106-55(28-20-38-97-83(92)93)72(123)102-50(10)68(119)110-64(46(5)6)78(129)112-66(81(132)133)48(8)12-2)111-75(126)56(32-33-61(89)115)104-62(116)43-99-70(121)58(42-45(3)4)109-74(125)54(26-15-18-36-87)107-76(127)59-30-22-40-113(59)80(131)60-31-23-41-114(60)79(130)57(29-21-39-98-84(94)95)108-69(120)51(88)24-13-16-34-85/h45-60,64-66H,11-44,85-88H2,1-10H3,(H2,89,115)(H,99,121)(H,100,128)(H,101,122)(H,102,123)(H,103,117)(H,104,116)(H,105,118)(H,106,124)(H,107,127)(H,108,120)(H,109,125)(H,110,119)(H,111,126)(H,112,129)(H,132,133)(H4,90,91,96)(H4,92,93,97)(H4,94,95,98)/t47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,64-,65-,66-/m0/s1
    MOLECULAR FORMULA
    C84H154N30O19
    CROSS REFERENCES
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    canSAR1083146
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1887.20
    AlogP-7.29
    HBond donors37
    HBond acceptors49
    Atoms287
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1083146.