UCSF

ZINC02791415

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 35 No

Popular Name: 4-benzyl-5-[(5S,7S)-5-p-cumenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl] 4-benzyl-5-[(5S,7S)-5-p-cumenyl-…

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) 6.33 14.86 -53.68 1 6 -1 61 497.57 6 ↓
Hi High (pH 8-9.5) 5.78 14.13 -8.99 2 6 0 67 498.578 6 ↓
Mid Mid (pH 6-8) 6.51 14.75 -44.3 2 6 0 65 498.578 6 ↓

Activity (Go SEA)

Rings

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