UCSF

ZINC49066989

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 23rd, 2010 19 No

Popular Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]-N-(4-methylthiazol-2-yl)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) 0.31 2.25 -65.95 2 6 1 81 304.417 4 ↓
Hi High (pH 8-9.5) 0.87 -0.65 -18.63 1 6 0 83 303.409 3 ↓
Mid Mid (pH 6-8) 0.13 1.67 -50.34 1 6 0 87 303.409 4 ↓

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

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