UCSF

ZINC65534906

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 27 Yes

Popular Name: 2-(1-azocanyl)-N'-(4-methoxy-2,3-dimethylbenzylidene)acetohydrazide 2-(1-azocanyl)-N'-(4-methoxy-2,3…

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Other Names:

MFCD00811638

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) 1.19 5.81 -32.41 4 7 1 92 369.493 5 ↓
Hi High (pH 8-9.5) 1.19 5.04 -16.19 3 7 0 91 368.485 5 ↓
Mid Mid (pH 6-8) 1.19 6.24 -69.54 5 7 2 94 370.501 5 ↓

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Rings

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

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