UCSF

ZINC34667695

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 32 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) 3.41 11.3 -18.69 1 6 0 66 430.483 5
Mid Mid (pH 6-8) 3.41 11.64 -48.45 2 6 1 67 431.491 5

Activity (Go SEA)

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