UCSF

ZINC39750429

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2010 26 No

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Annotations

Vendors

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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) 2.83 4.37 -15.6 2 7 0 97 370.796 6
Hi High (pH 8-9.5) 2.90 3.25 -50.46 1 7 -1 103 369.788 6

Activity (Go SEA)

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