UCSF

ZINC11818532

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2008 25 No

Popular Name: 1-[(2-fluorophenyl)methyl]-2-isopropylsulfonyl-5-(isoxazolidin-2-ylmethyl)imidazole 1-[(2-fluorophenyl)methyl]-2-iso…

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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) 2.37 -3.17 -15.04 0 6 0 64 367.446 6 ↓
Mid Mid (pH 6-8) 2.37 -2.9 -31.54 1 6 1 66 368.454 6 ↓

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

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