UCSF

ZINC02573205

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 3-(4-Chloro-3-nitro-pyrazol-1-ylmethyl)-4-methoxy-benzaldehyde 3-(4-Chloro-3-nitro-pyrazol-1-yl…

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CAS Number: 514801-13-9

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) 2.44 2.55 -19.68 0 7 0 89 295.682 5 ↓

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

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