UCSF

ZINC36332584

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2009 20 No

Popular Name: 7-(1,1-dioxothian-4-yl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-amine 7-(1,1-dioxothian-4-yl)-5,6-dime…

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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) 0.62 4.53 -18.94 2 6 0 91 294.38 1 ↓
Lo Low (pH 4.5-6) 0.62 4.97 -38.5 3 6 1 92 295.388 1 ↓

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

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