| BioID | bio1455 |
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| Name | GRAMICIDIN S |
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| ChEMBL ID | CHEMBL373496 |
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| Molecular Formula | C60H92N12O10 |
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| Molecular Weight | 1141.47 |
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| Molecular Weight (Monoisotopic) | 1140.7059 |
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| Type | Protein |
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| Max Phase | Phase 2 |
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| Target ID | Tar11 |
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| Target Name | Proto-oncogene c-RAF (c-RAF) |
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| Synonyms | GRAMICIDIN C|GRAMICIDIN S|GRAMICIDIN S 1|GRAMICIDIN S-A|GRAMICIDINA S|GRAMICIDINE S|GRAMMIDIN |
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| Smiles | CC(C)C[C@@H]1NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC1=O |
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| Inchi | InChI=1S/C60H92N12O10/c1-35(2)31-43-53(75)67-45(33-39-19-11-9-12-20-39)59(81)71-29-17-25-47(71)55(77)70-50(38(7)8)58(80)64-42(24-16-28-62)52(74)66-44(32-36(3)4)54(76)68-46(34-40-21-13-10-14-22-40)60(82)72-30-18-26-48(72)56(78)69-49(37(5)6)57(79)63-41(23-15-27-61)51(73)65-43/h9-14,19-22,35-38,41-50H,15-18,23-34,61-62H2,1-8H3,(H,63,79)(H,64,80)(H,65,73)(H,66,74)(H,67,75)(H,68,76)(H,69,78)(H,70,77)/t41-,42-,43-,44-,45+,46+,47-,48-,49-,50-/m0/s1 |
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| Inchi Key | IUAYMJGZBVDSGL-XNNAEKOYSA-N |
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| Molecular Species | None |
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| Targets | 37.0 |
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| Bioactivities | 203.0 |
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| Np Likeness Score | None |
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| Records Key | ['GS', 'gramicidin S, GS', 'GS, gramicidin S', 'GS, Gramicidin S', 'GS', 'GS, gramicidin S', 'gramicidin S', 'GS, Gramicidin S', 'Gramicidin S', 'GS', 'GS', 'GS', 'SID144205096', 'Gramicidin S', '1', 'GRAMICIDIN S', 'GS', 'COVC-2284160221', 'GS', 'SID174006635', 'Gramicidin S', 'GS', 'Gramicidin S', 'GS', 'Gramicidin S'] |
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| Records Name | ['Gramicidin S', 'cyclo-(VOLFPVOLFP)', 'cyclo(-Val1-Orn2-Leu3-D-Phe4-Pro5-)2', 'cyclo(Val-Orn-Leu-D-Phe-Pro)2', 'gramicidin S', 'cyclo(Val-Orn-Leu-D-Phe-Pro)2', 'gramicidin S', 'cyclo(Val-Orn-Leu-D-phe-Pro)2', 'Gramicidin S', 'Gramicidin s', 'Gramicidin S', 'gramicidin S', 'SID144205096', 'Gramicidin S', 'gramicidin S', 'GRAMICIDIN S', 'Gramicidin S', 'GRAMICIDIN S', 'Gramicidin S; Cyclo(-Leu-Dphe-Pro-Val-Orn-Leu-Dphe-Pro-Val-Orn-)', 'SID174006635', 'Gramicidin S', 'Gramicidin S', 'Gramicidin S', 'Gramicidin S', 'Gramicidin S'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
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