UCSF

ZINC52951405

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2010 21 No

Popular Name: (2S)-2-[(3R)-1,1-dioxothiolan-3-yl]-3-(1-ethylpyrazol-4-yl)-N-isopropyl-propan-1-amine (2S)-2-[(3R)-1,1-dioxothiolan-3-…

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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) 1.60 4.74 -65.9 2 5 1 69 314.475 7 ↓

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

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