UCSF

ZINC01731762

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 13 Yes

Popular Name: 4-carbamoyl-2-acetamidobutanoic acid 4-carbamoyl-2-acetamidobutanoic …

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2490-97-3 , 35305-74-9 , 5817-09-4

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) -3.49 -0.82 -59.92 3 6 -1 112 187.175 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 193 - 195 Enamine Building Blocks
MP 193...195 Enamine Building Blocks
MP 206-208 °C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
UniProt Database Links A4GCT_HUMAN; AG10A_HUMAN; AG10B_HUMAN; AG10B_MOUSE; AG10B_RAT; AGI_URTDI; AGM1_ARATH; AGM1_CANAX; AGM1_ENCCU; AGM1_HUMAN; AGM1_MOUSE; AGM1_ORYSJ; AGM1_SCHPO; AGM1_YEAST; AGM2_SCHPO; AGTA_DICDI; ALG10_ASHGO; ALG10_ASPFU; ALG10_CANAL; ALG10_CANGA; ALG10_DEB ChEBI

Activity (Go SEA)

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