UCSF

ZINC02614470

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2004 34 Yes

Popular Name: N-(3-chloro-4-methoxy-phenyl)-2-[(4-keto-5-tetralin-6-yl-1H-thieno[2,3-d]pyrimidin-2-yl)thio]acetami N-(3-chloro-4-methoxy-phenyl)-2-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 6.59 10.62 -19.83 2 6 0 84 512.056 6 ↓
Hi High (pH 8-9.5) 7.05 9.38 -48.64 1 6 -1 87 511.048 6 ↓

Activity (Go SEA)

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