UCSF

ZINC48260841

Substance Information

In ZINC since Heavy atoms Benign functionality
September 13th, 2010 22 Yes

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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) 3.06 9.39 -10.1 0 5 0 49 289.342 3
Lo Low (pH 4.5-6) 3.06 9.74 -26.96 1 5 1 50 290.35 3

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

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