UCSF

ZINC65533544

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 25 Yes

Popular Name: N~1~,N~1~-diethyl-N~4~-[(5-nitro-2-furyl)methylene]-1,4-benzenediamine N~1~,N~1~-diethyl-N~4~-[(5-nitro…

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Other Names:

MFCD01042253

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) 2.69 5.79 -43.81 3 5 1 62 357.503 5 ↓
Hi High (pH 8-9.5) 2.69 4.52 -9.2 2 5 0 57 356.495 5 ↓

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

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