UCSF

ZINC03869933

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 11 No

Popular Name: 3-Phosphoglyceric Acid 3-Phosphoglyceric Acid

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CAS Number: 820-11-1

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) -2.38 -0.86 -203.02 1 7 -3 133 183.032 4 ↓
Mid Mid (pH 6-8) -2.38 -2.02 -98.12 2 7 -2 130 184.04 4 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.10e+01 g/l DrugBank-experimental
UniProt Database Links ACEA_CORGL; ACEA_ECOLI; ACEA_SALTY; ADPP_ECO57; ADPP_ECOL6; ADPP_ECOLI; ADPP_SHIFL; ALPH_SYNE7; APGM1_ARCFU; APGM1_METJA; APGM1_METTH; APGM2_ARCFU; APGM2_METJA; APGM2_METTH; APGM_AERPE; APGM_AQUAE; APGM_DEIGD; APGM_DEIRA; APGM_GEOSL; APGM_IGNH4; APGM_META ChEBI
UniProt Database Links ACEA_CORGL; ACEA_ECOLI; ACEA_SALTY; ALPH_SYNE7; APGM1_ARCFU; APGM1_METJA; APGM1_METTH; APGM2_ARCFU; APGM2_METJA; APGM2_METTH; APGM_AERPE; APGM_AQUAE; APGM_DEIGD; APGM_DEIRA; APGM_GEOSL; APGM_IGNH4; APGM_META3; APGM_METAC; APGM_METBF; APGM_METBU; APGM_METK ChEBI
PUBCHEM_PATENT_ID EP0155007A2; EP0155007B1; EP0156242A2; EP0156242B1; EP0258290A1; EP0292171A2; EP0912750A1; EP0954749A1; EP1001029A1; US4019961; US4236349; US4546095; US4553972; US4710378; US4738926; US4757052; US4774088; US4900730; US4933286; US4944920; US4971760; US5011 IBM Patent Data
Patent Database Links EP1616883 ChEBI

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