UCSF

ZINC36118436

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 25 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) 3.08 11.29 -8.49 0 5 0 54 339.439 2
Mid Mid (pH 6-8) -0.50 9.57 -23.18 1 5 1 56 340.447 1

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

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