UCSF

ZINC38577540

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 16 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) 1.47 6.2 -85.9 1 3 0 30 269.42 0
Mid Mid (pH 6-8) 1.47 3.92 -48.63 0 3 -1 29 268.412 0

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

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