UCSF

ZINC72194484

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2012 21 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) 1.41 3.84 -49.06 2 4 1 43 288.367 1
Hi High (pH 8-9.5) 1.41 1.28 -8.44 1 4 0 42 287.359 1

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

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