canSAR825588
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)CC
    InChI
    InChI=1S/C75H129N25O24/c1-10-36(6)58(70(120)87-34-54(106)91-47(30-55(107)108)67(117)95-48(31-56(109)110)68(118)99-59(37(7)11-2)71(121)96-46(29-51(79)103)66(116)93-44(73(123)124)21-17-27-85-75(82)83)100-72(122)60(38(8)12-3)98-61(111)39(9)88-65(115)45(28-40-18-14-13-15-19-40)94-63(113)43(23-25-50(78)102)92-62(112)41(20-16-26-84-74(80)81)90-53(105)33-86-69(119)57(35(4)5)97-64(114)42(22-24-49(77)101)89-52(104)32-76/h35-48,57-60H,10-34,76H2,1-9H3,(H2,77,101)(H2,78,102)(H2,79,103)(H,86,119)(H,87,120)(H,88,115)(H,89,104)(H,90,105)(H,91,106)(H,92,112)(H,93,116)(H,94,113)(H,95,117)(H,96,121)(H,97,114)(H,98,111)(H,99,118)(H,100,122)(H,107,108)(H,109,110)(H,123,124)(H4,80,81,84)(H4,82,83,85)/t36-,37-,38-,39-,41-,42-,43-,44-,45-,46-,47-,48-,57-,58-,59-,60-/m0/s1
    MOLECULAR FORMULA
    C75H129N25O24
    CROSS REFERENCES
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    canSAR825588
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1763.96
    AlogP-8.77
    HBond donors34
    HBond acceptors49
    Atoms253
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR825588.