UCSF

ZINC37828238

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 19 No

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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) 0.63 8.33 -53.52 0 6 -1 87 286.329 5
Lo Low (pH 4.5-6) 0.63 6.37 -17.91 1 6 0 84 287.337 5

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

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