UCSF

ZINC20119266

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 28 No

Popular Name: (3aS,6aR)-3-[2-(4-fluorophenyl)ethyl]-5-[(5-isobutyl-1H-pyrazol-3-yl)methyl]-3a,4,6,6a-tetrahydropyr (3aS,6aR)-3-[2-(4-fluorophenyl)e…

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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) 3.45 8.14 -20.95 1 6 0 61 386.471 7 ↓

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

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