UCSF

ZINC28022596

Substance Information

In ZINC since Heavy atoms Benign functionality
February 23rd, 2009 22 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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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) 2.64 7.67 -10.49 2 4 0 62 312.394 2
Hi High (pH 8-9.5) 3.82 6.65 -49.21 1 4 -1 65 311.386 2
Lo Low (pH 4.5-6) 3.82 6.08 -11 2 4 0 62 312.394 2

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