UCSF

ZINC19374032

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 23 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) 2.49 6.77 -13.94 1 6 0 68 302.341 4
Lo Low (pH 4.5-6) 2.49 7.2 -43.45 2 6 1 69 303.349 4

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

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