UCSF

ZINC42432797

Substance Information

In ZINC since Heavy atoms Benign functionality
April 28th, 2010 11 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) -0.07 0.55 -33.24 2 3 1 37 158.221 3
Hi High (pH 8-9.5) -0.07 -1.84 -6.67 1 3 0 36 157.213 3

Activity (Go SEA)

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