UCSF

ZINC34367683

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 33 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) -0.28 -8.65 -20.09 8 12 0 207 466.395 3
Hi High (pH 8-9.5) -0.28 -7.65 -62.78 7 12 -1 209 465.387 3

Activity (Go SEA)

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