UCSF

ZINC65533080

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 28 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) 1.90 4.83 -38.37 2 7 1 67 377.472 4
Hi High (pH 8-9.5) 1.90 3.26 -11.68 1 7 0 65 376.464 4
Mid Mid (pH 6-8) 1.90 5.14 -92.2 3 7 2 68 378.48 4

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

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