UCSF

ZINC39963748

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2010 19 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) 5.04 8.08 -8.64 1 2 0 25 317.161 2
Mid Mid (pH 6-8) 5.04 8.52 -28.42 2 2 1 26 318.169 2

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