UCSF

ZINC05411227

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2006 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) 1.61 5.47 -17.6 2 5 0 66 299.153 2
Hi High (pH 8-9.5) 2.33 6.32 -111.5 0 5 -2 66 297.137 2
Mid Mid (pH 6-8) 2.33 5.55 -49.15 1 5 -1 63 298.145 2

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