UCSF

ZINC35636250

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 17 No

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Annotations

None

Vendors

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) -0.22 2.43 -46.71 4 6 -1 114 233.251 2
Mid Mid (pH 6-8) -0.22 2.42 -55.64 5 6 0 116 234.259 2
Mid Mid (pH 6-8) -0.22 1.88 -8.28 5 6 0 112 234.259 2

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

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