UCSF

ZINC59211389

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Substance Information

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

Popular Name: (2R)-1-[(2R)-2-amino-3-(1H-imidazol-5-yl)propanoyl]-1-[(2R)-3,3-dimethyl-4-oxo-azetidine-2-carbonyl] (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) -5.01 -0.18 -52.92 6 10 1 161 377.425 5 ↓
Hi High (pH 8-9.5) -4.89 -1.27 -49.47 5 10 0 165 376.417 5 ↓
Mid Mid (pH 6-8) -5.01 0.33 -107.58 7 10 2 162 378.433 5 ↓

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

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