UCSF

ZINC49320283

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 20 No

Popular Name: 1-isopropyl-4-[[methyl-[(1S)-1-(5-methyl-2-thienyl)ethyl]amino]methyl]tetrazole-5-thione 1-isopropyl-4-[[methyl-[(1S)-1-(…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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 7.6 -7.48 0 5 0 39 311.48 5 ↓
Mid Mid (pH 6-8) 2.21 9.94 -34.82 1 5 1 40 312.488 5 ↓

Activity (Go SEA)

Rings

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

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