UCSF

ZINC59214302

Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2011 34 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) 5.57 14.78 -60.51 3 9 0 139 509.621 26
Hi High (pH 8-9.5) 5.57 14.4 -52.54 2 9 -1 137 508.613 26

Activity (Go SEA)

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