UCSF

ZINC36691721

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2009 19 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) 0.63 3.72 -23.29 3 8 0 127 279.281 3
Hi High (pH 8-9.5) 0.70 2.05 -51.76 2 8 -1 133 278.273 3

Activity (Go SEA)

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