UCSF

ZINC65534758

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Substance Information

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

Popular Name: (3aR)-5-isopropyl-N-[(1S)-1-methyl-2-(3-methyl-1H-pyrazol-5-yl)ethyl]-1,3a,4,6,7,8-hexahydropyrazolo (3aR)-5-isopropyl-N-[(1S)-1-meth…

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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) 1.50 5.07 -40.65 4 7 1 77 347.487 5 ↓
Hi High (pH 8-9.5) 1.50 4.11 -9.24 3 7 0 76 346.479 5 ↓

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

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