UCSF

ZINC39963500

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2010 28 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) 2.64 9.73 -22.39 1 5 0 64 375.403 3
Lo Low (pH 4.5-6) 2.64 10.11 -42.69 2 5 1 65 376.411 3

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