UCSF

ZINC03861073

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 12 Yes

Popular Name: D-Galactosamine hydrochloride D-Galactosamine hydrochloride

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CAS Numbers: 1772-03-8 , 66-84-2 , 7535-00-4 , N/A

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) -3.35 -12.7 -47.44 7 6 1 117 180.18 1 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 182 - 185 Acros Organics
ALOGPS_SOLUBILITY 5.51e+02 g/l DrugBank-experimental
UniProt Database Links AGAA_ECOLI; AGAI_ECOLI; AGAR_ECO57; AGAR_ECOL6; AGAR_ECOLI; AGAS_ECOLI; APOC3_BOVIN; CGAT1_HUMAN; CGAT1_MOUSE; CGAT2_HUMAN; CGAT2_MOUSE; CHIL3_MOUSE; CHSS1_HUMAN; CHSS1_MOUSE; CHSS2_CAEEL; CHSS2_HUMAN; CHSS2_MOUSE; CHSS3_HUMAN; CHSS3_MOUSE; CHSTE_HUMAN; C ChEBI
Melting_Point ca 183? dec. Alfa-Aesar
Melting_Point ca 183° dec. Alfa-Aesar
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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