UCSF

ZINC40435394

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 31 No

CAS Number: 1415-73-2

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Annotations

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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) -0.08 -6.64 -19.38 7 10 0 177 434.397 4
Hi High (pH 8-9.5) -0.08 -5.65 -70.35 6 10 -1 180 433.389 4
Hi High (pH 8-9.5) -0.08 -5.65 -72.86 6 10 -1 180 433.389 4

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