Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B67SWV
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| Binder Name |
2-[(3S,9S,12R,17R,20S,23S,26S)-12-Amino-17-[(2-amino-2-oxoethyl)carbamoyl]-20-(1H-imidazol-5-ylmethyl)-23-(1H-indol-3-ylmethyl)-2,5,8,11,19,22,25-heptaoxo-3-propan-2-yl-14,15-dithia-1,4,7,10,18,21,24-heptazabicyclo[24.3.0]nonacosan-9-yl]acetic acid
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| Synonyms |
CHEMBL1950039; BDBM50363994
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL
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| Formula |
C41H55N13O11S2
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| Canonical SMILES |
CC(C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N1)CC(=O)O)N)C(=O)NCC(=O)N)CC3=CN=CN3)CC4=CNC5=CC=CC=C54
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| InChI |
1S/C41H55N13O11S2/c1-20(2)34-41(65)54-9-5-8-30(54)40(64)51-26(10-21-13-45-25-7-4-3-6-23(21)25)38(62)50-27(11-22-14-44-19-48-22)39(63)52-29(37(61)46-15-31(43)55)18-67-66-17-24(42)35(59)49-28(12-33(57)58)36(60)47-16-32(56)53-34/h3-4,6-7,13-14,19-20,24,26-30,34,45H,5,8-12,15-18,42H2,1-2H3,(H2,43,55)(H,44,48)(H,46,61)(H,47,60)(H,49,59)(H,50,62)(H,51,64)(H,52,63)(H,53,56)(H,57,58)/t24-,26-,27-,28-,29-,30-,34-/m0/s1
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| InChIKey |
BCABKEPRFQBBLZ-ZSOIMIOSSA-N
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| PubChem Compound ID | ||||
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