UCSF

ZINC34849782

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 28 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) 0.33 9.19 -53.68 3 7 0 112 384.432 10
Hi High (pH 8-9.5) 0.33 8.07 -64.82 2 7 -1 108 383.424 10

Activity (Go SEA)

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