UCSF

ZINC39742943

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2010 27 No

Popular Name: 2-[[4-ethyl-5-(morpholinomethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-nitrothiazol-2-yl)acetamide 2-[[4-ethyl-5-(morpholinomethyl)…

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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) 0.45 5.45 -17.96 1 11 0 131 413.485 8 ↓
Hi High (pH 8-9.5) 0.63 4.21 -38.11 0 11 -1 137 412.477 8 ↓
Lo Low (pH 4.5-6) 0.45 7.61 -54.84 2 11 1 132 414.493 8 ↓

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