UCSF

ZINC31708224

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2009 28 No

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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) -2.54 -0.7 -93.26 1 11 -2 183 428.352 5
Hi High (pH 8-9.5) -2.54 0.28 -173.21 0 11 -3 186 427.344 5

Activity (Go SEA)

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