UCSF

ZINC02597049

Annotations

Vendors

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) -2.64 -10.12 -8.32 5 6 0 110 180.156 1

Vendor Notes

Note Type Comments Provided By
Mp [°C] 165 - 168 Acros Organics
UniProt Database Links AGAA_ZOBGA; AGAB_ZOBGA; AGAC_ZOBGA; AGAD_ZOBGA; PORA_BACPM; PORA_ZOBGA; PORB_BACPM; PORB_ZOBGA; PORC_ZOBGA; PORD_ZOBGA; PORE_ZOBGA ChEBI
UniProt Database Links AGLA_THEMA; ALD1_MOUSE; ALD1_RAT; ALD2_CRIGR; ALD2_MOUSE; ALDR_BOVIN; ALDR_ENCCU; ALDR_HORVU; ALDR_HUMAN; ALDR_MOUSE; ALDR_PIG; ALDR_RABIT; ALDR_RAT; ALRA_DICDI; ALRB_DICDI; ALRC_DICDI; ARAA_GEOSE; ARADH_AZOBR; ARAF_ECOLI; ARALA_AZOBR; CGIA_ALTFO; CGIA_ZO ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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