canSAR1085749
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H](CO)CC(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1C(N)=O
    InChI
    InChI=1S/C72H111N13O14/c1-37(87)74-51-25-3-14-40(51)64(91)79-55-29-7-18-44(55)68(95)83-59-33-11-22-48(59)71(98)82-57-31-9-20-46(57)67(94)78-53-27-5-16-42(53)63(90)75-38(36-86)35-61(88)76-52-26-4-15-41(52)65(92)80-56-30-8-19-45(56)69(96)84-60-34-12-23-49(60)72(99)85-58-32-10-21-47(58)70(97)81-54-28-6-17-43(54)66(93)77-50-24-2-13-39(50)62(73)89/h38-60,86H,2-36H2,1H3,(H2,73,89)(H,74,87)(H,75,90)(H,76,88)(H,77,93)(H,78,94)(H,79,91)(H,80,92)(H,81,97)(H,82,98)(H,83,95)(H,84,96)(H,85,99)/t38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-/m0/s1
    MOLECULAR FORMULA
    C72H111N13O14
    CROSS REFERENCES
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    canSAR1085749
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1381.84
    AlogP1.49
    HBond donors15
    HBond acceptors27
    Atoms210
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1085749.