UCSF

ZINC67028904

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2011 18 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) 2.08 5.76 -12.43 2 5 0 63 283.378 4
Mid Mid (pH 6-8) 1.33 4.97 -37.66 1 5 -1 70 282.37 3

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

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