UCSF

ZINC15122268

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2008 26 Yes

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) -3.19 0 -83.94 8 8 0 176 360.366 7

Vendor Notes

Note Type Comments Provided By
UniProt Database Links CP56_YEAST; DIT1_YEAST; DTR1_YEAST; GPXC_BRUMA; GPXC_BRUPA; GPXC_WUCBA; PERC_AEDAE; PERC_ANOGA; PERC_DROME; RRT12_YEAST; SMK1_YEAST ChEBI
PUBCHEM_PATENT_ID EP0675953A1; EP0906919A2; EP0977811A1; EP1029044A1; US4070483; US4863735; US4898878; US5223409; US5536814; US5569603; US5618532; US5627263; US5770434; US5780509; US5811515; US5817750; US5837500; US5866126; US5912234; US5955572; US5981478; US6096556; US612 IBM Patent Data
Patent Database Links US2008187567 ChEBI

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

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