UCSF

ZINC62034238

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 21 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) 2.67 6.17 -13.68 4 4 0 67 287.338 5
Lo Low (pH 4.5-6) 2.67 6 -58.12 5 4 1 69 288.346 5

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

No pre-computed analogs available. Try a structural similarity search.