UCSF

ZINC39392508

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) 1.11 4.1 -43.71 3 3 1 46 217.292 1
Ref Reference (pH 7) 1.11 4.1 -43.75 3 3 1 46 217.292 1
Hi High (pH 8-9.5) 1.80 3.33 -47.25 3 3 0 55 216.284 1

Vendor Notes

Note Type Comments Provided By
MP 304 - 306 Enamine Building Blocks
MP 304...306 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID US4410528 IBM Patent Data

Activity (Go SEA)

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