UCSF

ZINC58555065

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2011 47 No

Popular Name: 16-[ethyl(methyl)dispiro[BLAH]carbonyl]oxyhexadecanoic 16-[ethyl(methyl)dispiro[BLAH]ca…

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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) 9.05 22.05 -59.2 2 9 0 114 657.937 19 ↓
Hi High (pH 8-9.5) 9.05 21.17 -48.3 1 9 -1 113 656.929 19 ↓
Lo Low (pH 4.5-6) 9.05 20.07 -26.74 3 9 1 111 658.945 19 ↓

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

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