UCSF

ZINC13713355

Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 26 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) 4.92 9.4 -11.98 0 4 0 38 347.462 3
Ref Reference (pH 7) 4.92 9.68 -10.34 0 4 0 38 347.462 3
Mid Mid (pH 6-8) 4.92 11.97 -41.18 1 4 1 39 348.47 3

Activity (Go SEA)

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