UCSF

ZINC49383558

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 24 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) 2.50 7.68 -22.76 1 6 0 66 352.366 4
Hi High (pH 8-9.5) 2.32 6.33 -50.6 0 6 -1 72 351.358 4

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

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