UCSF

ZINC49378811

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 25 Yes

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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) 1.17 4 -28.08 3 8 0 109 359.411 6
Hi High (pH 8-9.5) 0.99 2.67 -61.86 2 8 -1 115 358.403 6

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

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