canSAR735138
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(C)C
    InChI
    InChI=1S/C103H187N29O26/c1-49(2)41-65(108)89(143)126-71(43-51(5)6)96(150)123-68(35-27-31-39-106)92(146)121-69(36-28-32-40-107)93(147)132-81(56(15)16)102(156)128-72(44-52(7)8)97(151)122-67(34-26-30-38-105)91(145)117-59(19)83(137)113-58(18)82(136)114-61(21)86(140)120-66(33-25-29-37-104)90(144)116-60(20)84(138)115-62(22)87(141)124-70(42-50(3)4)98(152)127-75(47-77(110)134)94(148)118-63(23)88(142)130-80(55(13)14)101(155)129-73(45-53(9)10)99(153)131-79(54(11)12)100(154)111-48-78(135)112-57(17)85(139)125-74(46-76(109)133)95(149)119-64(24)103(157)158/h49-75,79-81H,25-48,104-108H2,1-24H3,(H2,109,133)(H2,110,134)(H,111,154)(H,112,135)(H,113,137)(H,114,136)(H,115,138)(H,116,144)(H,117,145)(H,118,148)(H,119,149)(H,120,140)(H,121,146)(H,122,151)(H,123,150)(H,124,141)(H,125,139)(H,126,143)(H,127,152)(H,128,156)(H,129,155)(H,130,142)(H,131,153)(H,132,147)(H,157,158)/t57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,79-,80-,81-/m0/s1
    MOLECULAR FORMULA
    C103H187N29O26
    CROSS REFERENCES
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    canSAR735138
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight2246.42
    AlogP-6.68
    HBond donors37
    HBond acceptors55
    Atoms345
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR735138.