UCSF

ZINC62772199

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 11th, 2011 16 Yes

Popular Name: 2-[(1S)-2-(2-furyl)-1-methyl-ethyl]-4-iodo-5-methyl-pyrazol-3-amine 2-[(1S)-2-(2-furyl)-1-methyl-eth…

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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) 2.65 6.07 -5.41 2 4 0 57 331.157 3 ↓
Lo Low (pH 4.5-6) 2.65 6.19 -28.4 3 4 1 58 332.165 3 ↓

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

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