UCSF

ZINC20468947

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2008 17 No

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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) 3.64 8.35 -5.51 0 2 0 16 248.757 4
Mid Mid (pH 6-8) 3.64 8.68 -25.26 1 2 1 17 249.765 4

Activity (Go SEA)

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