UCSF

ZINC05141913

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 27 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) 4.89 12.05 -11.65 0 4 0 46 393.899 4
Lo Low (pH 4.5-6) 4.89 12.33 -43.25 1 4 1 47 394.907 4

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