CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00446728" in compound.

Total 1 results found.

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CFAM Mol ID CFAMM00446728
Family CFFBM18327 Muscarinic acetylcholine receptor M3 and Muscarinic acetylcholine receptor M2 ligand propan-2-yl 5-[[(2S)-3-(4-hydroxyphenyl)-1-[[(3S)-1-[(4-hydroxyphenyl)methyl]-1-methylpiperidin-1-ium-3-yl]amino]-1-oxopropan-2-yl]carbamoylamino]thiophene-2-carboxylate;iodide family
Superfamily CFSBM5283 Alpha-1D adrenergic receptor and Alpha-1A adrenergic receptor Binder Superfamily 5
Class CFCID208 Class 1558
External ID CHEMBL553448 External Source CHEMBL
PubChem CID 45266409 Functional Category Bioactive
Molecule Name cyclohexyl 5-[[(2S)-3-(4-hydroxyphenyl)-1-[[(3S)-1-[(4-hydroxyphenyl)methyl]-1-methylpiperidin-1-ium-3-yl]amino]-1-oxopropan-2-yl]carbamoylamino]thiophene-2-carboxylate;iodide
IUPAC Name cyclohexyl 5-[[(2S)-3-(4-hydroxyphenyl)-1-[[(3S)-1-[(4-hydroxyphenyl)methyl]-1-methylpiperidin-1-ium-3-yl]amino]-1-oxopropan-2-yl]carbamoylamino]thiophene-2-carboxylate;iodide
InChi InChI=1S/C34H42N4O6S.HI/c1-38(21-24-11-15-27(40)16-12-24)19-5-6-25(22-38)35-32(41)29(20-23-9-13-26(39)14-10-23)36-34(43)37-31-18-17-30(45-31)33(42)44-28-7-3-2-4-8-28;/h9-18,25,28-29H,2-8,19-22H2,1H3,(H4-,35,36,37,39,40,41,42,43);1H/t25-,29-,38?;/m0./s1
Formula C34H43IN4O6S Molecular Weight 762.70
Cross Link CHEMBL553448

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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