UCSF

ZINC02738281

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 17 No

Popular Name: 2-(3,5-Dimethyl-4-nitro-pyrazol-1-yl)-propionic acid ethyl ester 2-(3,5-Dimethyl-4-nitro-pyrazol-…

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CAS Numbers: , 494747-21-6

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) 1.32 6.76 -12.34 0 7 0 90 241.247 5 ↓

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

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