UCSF

ZINC87491428

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2013 20 Yes

Popular Name: (S)-N-[2-(2-Thienyl)ethyl]-2-chlorophenyl glycine methyl ester HCl (S)-N-[2-(2-Thienyl)ethyl]-2-chl…

Find On: PubMed — Wikipedia — Google

CAS Number: [141109-19-5]

Other Names:

MFCD08458449

MFCD08460122

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) 4.24 10.85 -6.48 0 3 0 30 309.818 7 ↓

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.