UCSF

ZINC43221561

Substance Information

In ZINC since Heavy atoms Benign functionality
May 10th, 2010 36 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) 2.33 13.09 -60.87 2 10 0 149 495.532 9
Hi High (pH 8-9.5) 2.33 11.97 -71.7 1 10 -1 145 494.524 9

Activity (Go SEA)

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