UCSF

ZINC01888744

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 10 Yes

Popular Name: Ala-Gly Ala-Gly

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1188-01-8 , 687-69-4

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -3.04 -4.49 -63.15 4 5 0 96 146.146 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 225 TCI
MP 249-255 °C (dec.) Indofine
UniProt Database Links HALL_DICDI; HUTH_ACIAC; HUTH_ACICJ; HUTH_AGRRH; HUTH_AGRRK; HUTH_AGRT5; HUTH_AGRVS; HUTH_ALKOO; HUTH_ANAD2; HUTH_ANADE; HUTH_ANASK; HUTH_AROAE; HUTH_BACA2; HUTH_BACAA; HUTH_BACAC; HUTH_BACAH; HUTH_BACAN; HUTH_BACC0; HUTH_BACC1; HUTH_BACC2; HUTH_BACC3; HUT ChEBI

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
S15A2-1-E Solute Carrier Family 15 Member 2 (cluster #1 Of 1), Eukaryotic Eukaryotes 7000 0.72 ADME/T ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
S15A2_HUMAN Q16348 Solute Carrier Family 15 Member 2, Human 7000 0.72 ADME/T ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Proton/oligonucleotide cotransporters

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.