UCSF

ZINC43429633

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 18 Yes

Popular Name: (2S)-2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]-3-methyl-butanoic (2S)-2-[[(1R)-1-(2-methoxyphenyl…

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) 0.96 7.09 -32.69 2 4 0 66 251.326 6 ↓

Activity (Go SEA)

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