UCSF

ZINC42452346

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 17 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) 2.17 5.29 -35.83 4 4 1 63 301.208 6
Hi High (pH 8-9.5) 2.17 3.23 -5.64 3 4 0 62 300.2 6

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Rings

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