UCSF

ZINC49382121

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 30 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) 3.03 10.45 -21.1 1 8 0 92 448.932 7
Hi High (pH 8-9.5) 2.85 9.11 -53.05 0 8 -1 98 447.924 7

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

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