UCSF

ZINC56736463

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 8th, 2011 25 Yes

Popular Name: 1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]urea 1-(5-tert-butyl-1,3,4-thiadiazol…

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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) 3.38 7.92 -55.66 3 6 1 71 366.486 6 ↓
Mid Mid (pH 6-8) 3.38 5.84 -17.58 2 6 0 70 365.478 6 ↓

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

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