| Phytochemical Name : Indirubin |
| PCNDIDI0015 |
| Pubchem CID : 10177 |
| Molecular formula: C16H10N2O2 |
| Canonical SMILES : C1=CC=C2C(=C1)C(=C(N2)O)C3=NC4=CC=CC=C4C3=O |
Synonymes : Indirubin|479-41-4|Indigo Red|Couroupitine B|Indigopurpurin|906748-38-7|(Z)-[2,3'-biindolinylidene]-2',3-dione|[2,3'-Biindolinylidene]-2',3-dione|397242-72-7|Isoindirubin|Isoindirubine|Isoindogotin|(E)-[2,3'-biindolinylidene]-2',3-dione|Indirubin [MI]|NSC 105327|NSC-105327|2H-Indol-2-one, 3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-|C.I. 73200|Indirubin 3E-form [MI]|3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one|BRN 0088279|1LXW6D3W2Z|UNII-V86L8P74GI|V86L8P74GI|2-(2-hydroxy-1H-indol-3-yl)indol-3-one|C.I. 75790|3-(1,3-dihydro-3-oxo-2h-indol-2-ylidene)-1,3-dihydro-2h-indol-2-one|MFCD00956441|(Z)-[2,3 inverted exclamation mark -Biindolinylidene]-2 inverted exclamation mark ,3-dione|(delta2,3'-Biindoline)-2',3-dione|(3Z)-3-(1,3-Dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-2H-indol-2-one|(delta(sup 2,3')-BIINDOLINE)-2',3-DIONE|5-24-08-00507 (Beilstein Handbook Reference)|MFCD00221745|(3E)-3-(1,3-Dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-2H-indol-2-one|3-(1,3-dihydro-3-oxo-2h-indol-2-ylidene)-1,3-dihydro-2h-indol-2-on|2H-Indol-2-one, 3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-, (3E)-|SMR000466311|Indirubin,(S)|Indirubin- Bio-X|INDARUBICIN|CPD000466311|Indirubin derivative, 1|BiomolKI_000069|EM-A05-INDIRUBIN|[.DELTA.2,3-dione|BiomolKI2_000073|UNII-1LXW6D3W2Z|INDIRUBIN [WHO-DD]|(3Z)-3-(3-oxoindolin-2-ylidene)indolin-2-one|SCHEMBL27678|BMK1-G9|BSPBio_001110|KBioGR_000450|KBioSS_000450|MLS000759416|MLS001424211|MLS002473308|MLS006010732|CHEMBL35349|BDBM7392|CHEMBL259664|SCHEMBL9899338|(3E)-3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one|CHEMBL1276127|CHEMBL3185783|CHEBI:92322|cid_5318433|KBio2_000450|KBio2_003018|KBio2_005586|KBio3_000839|KBio3_000840|EX-A347|Bio2_000395|Bio2_000875|DTXSID201026053|DTXSID501026052|HMS1362H11|HMS1792H11|HMS1990H11|HMS2051H20|HMS2234G06|HMS3369O15|HMS3393H20|HMS3403H11|HMS3656O13|AMY39890|BCP28869|HY-N0117|AC1180|BDBM50023867|BDBM50349806|FD9058|NSC105327|s2386|2H-Indol-2-one,3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-|AKOS015895136|AKOS028108775|AKOS032455876|AC-8003|BCP9000788|CCG-100673|CCG-101058|CCG-267073|CS-3682|DB12379|NC00308|SB64698|IDI1_002150|(2'Z)-Indirubin, >=98% (HPLC)|NCGC00163356-01|NCGC00163356-02|NCGC00163356-03|NCGC00163356-04|NCGC00179302-02|(Z)-[2,3-Biindolinylidene]-2,3-dione|AC-29931|BI164578|CS-12423|LS-43983|SMR004701694|SY058396|3-(3-oxoindolin-2-ylidene)indolin-2-one|3-(3-indolinone-2-ylidene)-indolin-2-one|UNM-0000305766|FT-0627199|I0868|SW197688-2|(E)-[2,3-BIINDOLINYLIDENE]-2,3-DIONE|AB00639939-06|2-(2-oxo-1H-indol-3-ylidene)-1H-indol-3-one|A827403|A922429|SR-01000759396|Q-100514|Q1661452|SR-01000759396-5|BRD-K17894950-001-03-6|BRD-K17894950-001-04-4|C.I.73200;Couroupitine B;Indigo red;Indigopurpurin|Q27164070|3-(3-oxidanylidene-1H-indol-2-ylidene)-1H-indol-2-one|2H-Indol-2-one,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-|(3E)-3-(3-Oxo-1,3-dihydro-2H-indol-2-ylidene)-1,3-dihydro-2H-indo l-2-one|(Z)-[2,3invertedexclamationmark-Biindolinylidene]-2invertedexclamationmark,3-dione|2-[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2,3-dihydro-1H-indol-3-one |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.130 |
| Log Po/w (XLOGP3) : 2.730 |
| Log Po/w (WLOGP) : 2.810 |
| Log Po/w (MLOGP) : 1.700 |
| Log Po/w (SILICOS-IT) : 4.100 |
| Consensus Log Po/w : 2.690 |

