UCSF

ZINC61359906

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 21 Yes

Popular Name: 1,3-dimethyl-5-[[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]amino]methyl]pyrimidine-2,4-dione 1,3-dimethyl-5-[[[(4S)-4,5,6,7-t…

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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) 0.03 7.15 -51.78 2 5 1 61 306.411 3 ↓
Hi High (pH 8-9.5) 0.03 6.07 -15.38 1 5 0 56 305.403 3 ↓

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

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