UCSF

ZINC33767162

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 22 No

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Annotations

None

Vendors

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) 1.54 4.29 -93.27 0 6 -2 95 337.378 5
Lo Low (pH 4.5-6) 1.08 6.39 -52.88 1 6 -1 91 338.386 5

Activity (Go SEA)

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