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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL235363
CHEMBL235363
Compound Name SUBSTANCE P
ChEMBL Synonyms SID50112420
Max Phase 0
Trade Names
Molecular Formula C63H98N18O13S

Additional synonyms for CHEMBL235363 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC ...
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Standard InChI InChI=1S/C63H98N18O13S/c1-37(2)33-45(57(89)74-41(53(68)85)27 ...
Download InChI
Standard InChI Key ADNPLDHMAVUMIW-CUZNLEPHSA-N

Clinical Trials for Compound

Number of clinical trials registered at clinicaltrials.gov

Alternate Forms of Compound in ChEMBL


CHEMBL235363

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Ro5 Violations #Rotatable Bonds Ro3 Med Chem Friendly Molecular Species
1347.6 1346.7281 - - - - - -


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms Num Alerts QED Weighted
- - - - - - - -0

Compound Cross References

ChemSpider ChemSpider:ADNPLDHMAVUMIW-CUZNLEPHSA-N
PubChem SID: 50112420
Wikipedia Substance_P

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL235363



IUPHAR 2098
eMolecules 37036365
IBM Patent System 69F2880F4F6A302F339C3B0324317998
PubChem: Thomson Pharma 14890642
PubChem 36511

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/ADNPLDHMAVUMIW-CUZNLEPHSA-N spacer
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