UCSF

ZINC48421828

Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2010 18 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) 0.95 -3.02 -11.7 4 7 0 108 249.226 3
Hi High (pH 8-9.5) 1.13 -5.67 -42.89 3 7 -1 114 248.218 3

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