UCSF

ZINC67338348

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 8th, 2011 36 Yes

Popular Name: [3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-1-ethyl-pyrazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]de [3-[4-(2,3-dimethylphenyl)pipera…

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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) 1.93 8.1 -23.16 0 10 0 97 517.652 5 ↓
Mid Mid (pH 6-8) 1.93 7.7 -53.42 1 10 1 98 518.66 5 ↓

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Rings

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

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