UCSF

ZINC65528507

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 25 No

Popular Name: (2S,3aR,7R)-7-(3-methoxyphenyl)-2-[(3S)-5-methyl-3H-pyrazol-3-yl]-3,3a,5,6,7,8-hexahydro-2H-imidazo[ (2S,3aR,7R)-7-(3-methoxyphenyl)-…

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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) 1.92 -1.36 -14.18 2 7 0 87 339.399 3 ↓
Lo Low (pH 4.5-6) 1.92 -0.11 -41.5 3 7 1 92 340.407 3 ↓

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

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