UCSF

ZINC69917465

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 23 Yes

Popular Name: (1,3-dimethylthieno[2,3-c]pyrazol-5-yl)-[(3S)-3-imidazol-1-yl-1-piperidyl]methanone (1,3-dimethylthieno[2,3-c]pyrazo…

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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) 1.42 8.94 -40.92 1 6 1 57 330.437 2 ↓
Mid Mid (pH 6-8) 1.42 8.23 -14.94 0 6 0 56 329.429 2 ↓

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

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