UCSF

ZINC65513360

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2011 23 Yes

Popular Name: N-[3-(5-methyl-2-thienyl)-1,2,4-thiadiazol-5-yl]-1-prop-2-ynyl-piperidine-4-carboxamide N-[3-(5-methyl-2-thienyl)-1,2,4-…

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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) 2.72 6.4 -12.07 1 5 0 58 346.481 4 ↓
Mid Mid (pH 6-8) 2.72 8.68 -50.61 2 5 1 59 347.489 4 ↓

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

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