UCSF

ZINC53619553

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 34 No

Popular Name: (7S)-5-ethyl-N-[(1S)-1-[2-(1H-imidazol-5-yl)ethylcarbamoyl]-3-methylsulfanyl-propyl]-8-oxo-6,7-dihyd (7S)-5-ethyl-N-[(1S)-1-[2-(1H-im…

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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) 2.05 7.22 -78.96 4 10 0 133 487.582 10 ↓
Mid Mid (pH 6-8) 2.05 6.73 -60.58 3 10 -1 132 486.574 10 ↓
Lo Low (pH 4.5-6) 2.05 7.49 -82.57 5 10 1 134 488.59 10 ↓
Lo Low (pH 4.5-6) 2.05 6.41 -48.08 5 10 1 130 488.59 10 ↓

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

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