UCSF

ZINC13127679

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 26 Yes

Popular Name: N-[(7R)-7-(4-fluorophenyl)-5-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide N-[(7R)-7-(4-fluorophenyl)-5-phe…

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) 2.80 13 -22.24 1 6 0 72 349.369 3 ↓
Mid Mid (pH 6-8) 2.80 13.33 -42.71 2 6 1 74 350.377 3 ↓
Mid Mid (pH 6-8) 3.33 12.67 -98.43 4 6 2 82 351.385 3 ↓
Mid Mid (pH 6-8) 3.32 11.65 -34.64 2 6 1 77 350.377 3 ↓

Activity (Go SEA)

Rings

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