UCSF

ZINC00154813

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) -1.23 -4.77 -42.21 4 2 1 47 150.201 0

Vendor Notes

Note Type Comments Provided By
MP 118 - 121 Enamine Building Blocks
MP 118...121 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP0719247A1; EP0763005A1; EP0763005B1; EP0817765A1; EP0828702A1; EP0828702B1; US5495054; US5516943; US5599985; US5616808; US5677469; WO1995007880A1; WO1996036584A1; WO2000009463A1 IBM Patent Data

Activity (Go SEA)

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