UCSF

ZINC65508062

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: N4,N4,5-trimethyl-N2-[3-(1H-tetrazol-5-yl)propyl]pyrimidine-2,4-diamine N4,N4,5-trimethyl-N2-[3-(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) 0.76 5.8 -51.89 2 8 0 95 262.321 6 ↓
Hi High (pH 8-9.5) 0.76 5.42 -41.24 1 8 -1 94 261.313 6 ↓
Lo Low (pH 4.5-6) 0.76 5.8 -37.09 3 8 1 97 263.329 6 ↓

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

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