UCSF

ZINC36160806

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 18 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) -0.72 0.22 -129.15 4 5 2 69 277.434 3
Hi High (pH 8-9.5) -0.72 -0.64 -47.47 3 5 1 68 276.426 3

Activity (Go SEA)

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