UCSF

ZINC02781901

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 33 Yes

Popular Name: N-[5-[(1S)-1-ethylpentyl]-1,3,4-thiadiazol-2-yl]-5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyr N-[5-[(1S)-1-ethylpentyl]-1,3,4-…

Find On: PubMed — Wikipedia — Google

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) 5.75 11.51 -14.73 1 7 0 85 494.568 9 ↓
Hi High (pH 8-9.5) 5.82 10.37 -53.27 0 7 -1 91 493.56 9 ↓

Activity (Go SEA)

Rings

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