UCSF

ZINC58539027

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2011 23 No

Popular Name: 1-cyclohexyl-3-[1-[(2-thioxo-1,3,4-thiadiazol-3-yl)methyl]-4-piperidyl]urea 1-cyclohexyl-3-[1-[(2-thioxo-1,3…

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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) 2.13 6.94 -45.52 3 6 1 63 356.541 4 ↓
Hi High (pH 8-9.5) 2.13 4.57 -15.87 2 6 0 62 355.533 4 ↓

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

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