UCSF

ZINC27904398

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 21st, 2009 26 No

Popular Name: 4-[(3-bromo-2-hydroxy-5-nitro-phenyl)-(3-hydroxy-5-methyl-2H-pyrazol-4-yl)methyl]-5-methyl-2H-pyrazo 4-[(3-bromo-2-hydroxy-5-nitro-ph…

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) 2.37 -3.14 -33.53 4 10 -1 167 423.203 4 ↓
Mid Mid (pH 6-8) 2.37 -3.9 -14.46 5 10 0 164 424.211 4 ↓

Activity (Go SEA)

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