UCSF

ZINC65505019

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 28 No

Popular Name: (4S,7aS)-1-cyclohexyl-3-hydroxy-4-[(4S)-3-phenyl-4H-pyrazol-4-yl]-4,5,7,7a-tetrahydro-2H-pyrazolo[3, (4S,7aS)-1-cyclohexyl-3-hydroxy-…

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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) 2.60 3.07 -42.48 2 7 -1 92 378.456 3 ↓
Mid Mid (pH 6-8) 2.60 4.67 -27.26 3 7 0 93 379.464 3 ↓

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

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