UCSF

ZINC40561916

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2010 25 Yes

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Annotations

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) 2.81 8.86 -10.31 0 5 0 63 334.375 3
Lo Low (pH 4.5-6) 2.81 9.31 -41.77 1 5 1 65 335.383 3

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