UCSF

ZINC60555041

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 27th, 2011 22 No

Popular Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]-N-[(4-fluorophenyl)methyl]-N-methyl-acetamide 2-[[(3S)-1,1-dioxothiolan-3-yl]-…

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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) 0.78 5.69 -59.75 1 5 1 59 329.417 5 ↓
Mid Mid (pH 6-8) 0.78 3.27 -20.2 0 5 0 58 328.409 5 ↓

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

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