UCSF

ZINC49512567

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 27 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) 0.89 5.83 -44.87 3 7 1 79 372.424 6
Hi High (pH 8-9.5) 1.07 2.75 -49.12 1 7 -1 84 370.408 6
Mid Mid (pH 6-8) 0.89 3.62 -9.22 2 7 0 78 371.416 6

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