UCSF

ZINC23945728

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 31 No

Popular Name: N-[(4S)-4-methyl-2,5-dioxo-4-phenethyl-imidazolidin-1-yl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7 N-[(4S)-4-methyl-2,5-dioxo-4-phe…

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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) 1.38 6.39 -25.55 3 8 0 108 438.509 5 ↓
Hi High (pH 8-9.5) 2.46 5.76 -57.59 2 8 -1 114 437.501 5 ↓

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

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