UCSF

ZINC64547358

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 25 Yes

Popular Name: 3-(3-isopentyloxyphenyl)-1-methyl-1-[2-(2-pyridyl)ethyl]urea 3-(3-isopentyloxyphenyl)-1-methy…

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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) 4.01 9.55 -10.35 1 5 0 54 341.455 8 ↓
Lo Low (pH 4.5-6) 4.01 9.91 -35.09 2 5 1 56 342.463 8 ↓

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

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