UCSF

ZINC59211347

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2011 26 No

Popular Name: (2R)-1-[(2R)-2-amino-3-(1H-imidazol-5-yl)propanoyl]-1-[(2R,3R)-3-methyl-4-oxo-azetidine-2-carbonyl]p (2R)-1-[(2R)-2-amino-3-(1H-imida…

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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) -5.15 -0.23 -50.88 6 10 1 161 363.398 5 ↓
Hi High (pH 8-9.5) -5.05 -1.53 -54.19 5 10 0 165 362.39 5 ↓
Mid Mid (pH 6-8) -5.15 0.28 -105.53 7 10 2 162 364.406 5 ↓

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

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