UCSF

ZINC27523507

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2009 46 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) -5.69 -4.49 -134.84 14 20 0 351 659.698 19
Hi High (pH 8-9.5) -5.69 -4.59 -115.99 13 20 -1 349 658.69 19

Activity (Go SEA)

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