UCSF

ZINC03831141

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 36 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) 1.12 12.92 -75.57 2 9 0 122 498.576 12
Mid Mid (pH 6-8) 1.12 12.25 -68.59 1 9 -1 117 497.568 12

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