UCSF

ZINC34380653

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 31 No

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Annotations

Vendors

    None

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) -0.01 5.98 -33.07 4 8 0 135 489.322 5
Hi High (pH 8-9.5) -0.01 6.73 -53.26 3 8 -1 137 488.314 5
Hi High (pH 8-9.5) -0.01 5.13 -46.78 3 8 -1 130 488.314 5
Hi High (pH 8-9.5) -0.01 5.88 -105.55 2 8 -2 133 487.306 5

Activity (Go SEA)

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