UCSF

ZINC66449254

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 23 No

Popular Name: N-[[(3R)-1-[[5-(dimethylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-3-piperidyl]methyl]butanamide N-[[(3R)-1-[[5-(dimethylamino)-2…

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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) 1.95 8.97 -42.62 2 6 1 55 358.557 7 ↓
Hi High (pH 8-9.5) 1.95 6.57 -14.66 1 6 0 53 357.549 7 ↓

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

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