UCSF

ZINC12359624

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 18 Yes

Popular Name: 1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]homopiperazine hydrochloride 1-[3-Chloro-5-(trifluoromethyl)p…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1197238-46-2 , 231953-40-5 , 287114-27-6

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) 2.21 -0.86 -96.93 3 3 2 34 281.709 2 ↓

Activity (Go SEA)

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