UCSF

ZINC22683916

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 28 Yes

Popular Name: N-[(2R)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxami N-[(2R)-2-dimethylamino-2-(4-eth…

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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) 3.33 9.89 -58.29 3 5 1 63 398.552 6 ↓
Hi High (pH 8-9.5) 3.33 7.63 -14.5 2 5 0 61 397.544 6 ↓

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

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