UCSF

ZINC65495243

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 28 Yes

Popular Name: [2-(2-aminoethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]BLAHone [2-(2-aminoethyl)-5,6-dimethyl-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) 1.73 8.78 -52.11 3 6 1 79 396.54 3 ↓
Hi High (pH 8-9.5) 1.73 8.39 -20.54 2 6 0 77 395.532 3 ↓

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

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