UCSF

ZINC00033997

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 No

Popular Name: 1-Methyl-4-(4-nitrophenoxy)benzene 1-Methyl-4-(4-nitrophenoxy)benzene

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3402-74-2 , [3402-74-2]

Other Names:

MFCD00627972

OT-2450

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) 4.10 2.71 -5.48 0 4 0 55 229.235 3 ↓

Activity (Go SEA)

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