UCSF

ZINC20440484

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 26 Yes

Download: MOL2 SDF SMILES Flexibase

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) 3.73 7.85 -21.71 1 7 0 86 370.434 7
Hi High (pH 8-9.5) 3.25 6.93 -50.87 0 7 -1 93 369.426 7

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