canSAR141711
FEATURES
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NAMES
    SMILES
    C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N(C)CC(=O)O
    InChI
    InChI=1S/C56H105N25O15/c1-30(72-44(88)34(15-8-24-68-53(60)61)76-49(93)37(20-21-40(83)84)77-47(91)36(17-10-26-70-55(64)65)78-50(94)39-19-12-28-81(39)52(96)42(59)31(2)82)43(87)73-35(16-9-25-69-54(62)63)46(90)74-32(13-4-6-22-57)45(89)75-33(14-5-7-23-58)48(92)79-38(18-11-27-71-56(66)67)51(95)80(3)29-41(85)86/h30-39,42,82H,4-29,57-59H2,1-3H3,(H,72,88)(H,73,87)(H,74,90)(H,75,89)(H,76,93)(H,77,91)(H,78,94)(H,79,92)(H,83,84)(H,85,86)(H4,60,61,68)(H4,62,63,69)(H4,64,65,70)(H4,66,67,71)/t30-,31+,32-,33-,34-,35-,36-,37-,38-,39-,42-/m0/s1
    MOLECULAR FORMULA
    C56H105N25O15
    CROSS REFERENCES
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    canSAR141711
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1367.82
    AlogP-8.70
    HBond donors33
    HBond acceptors40
    Atoms201
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR141711.