UCSF

ZINC65529102

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 18 Yes

Popular Name: N4,N4,5-trimethyl-N2-[2-(1H-tetrazol-5-yl)ethyl]pyrimidine-2,4-diamine N4,N4,5-trimethyl-N2-[2-(1H-tetr…

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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) 0.49 5.04 -40.78 2 8 0 95 248.294 5 ↓
Hi High (pH 8-9.5) 0.49 4.65 -41.12 1 8 -1 94 247.286 5 ↓
Lo Low (pH 4.5-6) 0.49 5.03 -33.54 3 8 1 97 249.302 5 ↓

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

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