UCSF

ZINC69097209

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2011 27 Yes

Popular Name: (1S,4R,5S,6R)-6-[(2-isopropoxy-5-methoxycarbonyl-phenyl)carbamoyl]bicyclo[2.2.1]hept-2-ene-5-carboxy (1S,4R,5S,6R)-6-[(2-isopropoxy-5…

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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) 3.25 9.14 -60.86 1 7 -1 105 372.397 7 ↓
Lo Low (pH 4.5-6) 3.25 7.6 -20.92 2 7 0 102 373.405 7 ↓

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

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