UCSF

ZINC62319339

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2011 27 No

Popular Name: (E)-1-[4-[3-(diethylamino)propanoyl]piperazin-1-yl]-3-(2-fluorophenyl)-2-methyl-prop-2-en-1-one (E)-1-[4-[3-(diethylamino)propan…

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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) 2.76 10.74 -53.78 1 5 1 45 376.496 7 ↓
Hi High (pH 8-9.5) 2.76 8.55 -16.32 0 5 0 44 375.488 7 ↓

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

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