UCSF

ZINC13131379

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 23 Yes

Popular Name: (5S,7S)-5-(4-fluorophenyl)-7-phenyl-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine (5S,7S)-5-(4-fluorophenyl)-7-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) 2.90 10.06 -12.8 3 5 0 69 309.348 2 ↓
Lo Low (pH 4.5-6) 2.90 10.57 -34.51 4 5 1 70 310.356 2 ↓

Activity (Go SEA)

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