UCSF

ZINC36642285

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 35 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) 4.97 14.89 -64.79 1 9 1 96 498.629 9
Hi High (pH 8-9.5) 4.97 12.34 -13.98 0 9 0 95 497.621 9

Activity (Go SEA)

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