UCSF

ZINC39490407

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 26th, 2010 28 No

Popular Name: (3aS)-5-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-3-[(1S)-1-phenylpropyl]-3a,4,6,7-tetrahydropyrazol (3aS)-5-[[1-(2-methoxyethyl)imid…

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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) 3.05 8.95 -41.68 1 6 1 56 380.516 8 ↓
Hi High (pH 8-9.5) 3.05 8.5 -12.23 0 6 0 55 379.508 8 ↓

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

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