UCSF

ZINC14183879

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 2008 33 Yes

Popular Name: N-[(1R)-1,2-bis(4-methoxyphenyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide N-[(1R)-1,2-bis(4-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) 4.30 9.66 -19.04 2 6 0 77 462.571 7 ↓
Mid Mid (pH 6-8) 4.56 6.42 -39.39 3 6 1 85 463.579 7 ↓

Activity (Go SEA)

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