UCSF

ZINC05298799

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2006 19 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) 2.54 4.44 -16.44 2 5 0 68 265.309 7
Hi High (pH 8-9.5) 2.54 5.66 -56.46 1 5 -1 71 264.301 7

Activity (Go SEA)

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