UCSF

ZINC61364810

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 17 Yes

Popular Name: N-[(1S)-1-(3-thienyl)ethyl]thieno[3,2-d]pyrimidin-4-amine N-[(1S)-1-(3-thienyl)ethyl]thien…

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) 2.82 7.24 -7.5 1 3 0 38 261.375 3 ↓
Lo Low (pH 4.5-6) 2.82 7.7 -29.61 2 3 1 39 262.383 3 ↓

Activity (Go SEA)

Rings

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

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