Thr-Phe-Thr-Ser-Asp-Tyr-Ser-Lys-Tyr-Leu-Asp-Ser-NH2

ID: ALA440261

PubChem CID: 44278461

Max Phase: Preclinical

Molecular Formula: C64H92N14O23

Molecular Weight: 1425.52

Molecule Type: Protein

This compound is available for customization.

Associated Items:

Bioactivity Summary Target Summary Assay Summary

Names and Identifiers

Canonical SMILES: CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(N)=O

Standard InChI: InChI=1S/C64H92N14O23/c1-31(2)22-40(55(92)72-45(27-50(88)89)59(96)75-46(28-79)53(67)90)69-56(93)41(24-35-13-17-37(84)18-14-35)70-54(91)39(12-8-9-21-65)68-61(98)47(29-80)76-57(94)42(25-36-15-19-38(85)20-16-36)71-58(95)44(26-49(86)87)73-62(99)48(30-81)77-64(101)52(33(4)83)78-60(97)43(23-34-10-6-5-7-11-34)74-63(100)51(66)32(3)82/h5-7,10-11,13-20,31-33,39-48,51-52,79-85H,8-9,12,21-30,65-66H2,1-4H3,(H2,67,90)(H,68,98)(H,69,93)(H,70,91)(H,71,95)(H,72,92)(H,73,99)(H,74,100)(H,75,96)(H,76,94)(H,77,101)(H,78,97)(H,86,87)(H,88,89)/t32-,33-,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,51+,52+/m1/s1

Standard InChI Key: SHWYALKUKDZAEK-ICEQOEGCSA-N

Molfile:

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M  END

Associated Targets(non-human)

Adcy1 Adenylate cyclase (172 Activities)

Discover Target: Adcy1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Gcgr Glucagon receptor (262 Activities)

Discover Target: Gcgr

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Natural Product: No	Oral: No	Chemical Probe: No	Parenteral: No
Molecule Type: Protein	Topical: No	First In Class: No	Black Box: No
Chirality: No	Availability: No	Prodrug: No

Natural Product: No

Oral: No

Chemical Probe: No

Parenteral: No

Molecule Type: Protein

Topical: No

First In Class: No

Black Box: No

Chirality: No

Availability: No

Prodrug: No

Calculated Properties

Molecular Weight: 1425.52	Molecular Weight (Monoisotopic): 1424.6460	AlogP: ┄	#Rotatable Bonds: ┄
Polar Surface Area: ┄	Molecular Species: ┄	HBA: ┄	HBD: ┄
#RO5 Violations: ┄	HBA (Lipinski): ┄	HBD (Lipinski): ┄	#RO5 Violations (Lipinski): ┄
CX Acidic pKa: ┄	CX Basic pKa: ┄	CX LogP: ┄	CX LogD: ┄
Aromatic Rings: ┄	Heavy Atoms: ┄	QED Weighted: ┄	Np Likeness Score: ┄

Thr-Phe-Thr-Ser-Asp-Tyr-Ser-Lys-Tyr-Leu-Asp-Ser-NH2

Names and Identifiers

Alternative Forms

Associated Targets(non-human)

Molecule Features

Drug Indications

Mechanisms of Action

Calculated Properties

References

Source