UCSF

ZINC13253154

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 27 No

Popular Name: (1S,6S)-6-[[3-(4,5-dihydro-3H-pyrrol-2-ylsulfamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic (1S,6S)-6-[[3-(4,5-dihydro-3H-py…

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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) 1.40 5.67 -59.69 2 8 -1 128 390.441 5 ↓
Lo Low (pH 4.5-6) 1.40 4.2 -20.23 3 8 0 125 391.449 5 ↓

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

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