UCSF

ZINC62038820

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 34 No

Popular Name: (2R)-N-(5-formyl-2-hydroxy-phenyl)-2-[[5-(4-isopropylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]su (2R)-N-(5-formyl-2-hydroxy-pheny…

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) 6.12 8.37 -19.89 3 7 0 112 493.61 7 ↓
Hi High (pH 8-9.5) 6.58 7.12 -47.97 2 7 -1 115 492.602 7 ↓
Hi High (pH 8-9.5) 6.58 7.89 -94.53 1 7 -2 118 491.594 7 ↓

Activity (Go SEA)

Rings

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