UCSF

ZINC02521417

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 20 No

Popular Name: 3-(4-Nitro-phenoxymethyl)-benzoic acid 3-(4-Nitro-phenoxymethyl)-benzoi…

Find On: PubMed — Wikipedia — Google

CAS Number: 832739-66-9

Other Names:

MFCD03421907

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) 3.44 1.49 -54.46 0 6 -1 95 272.236 5 ↓

Activity (Go SEA)

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