UCSF

ZINC48614923

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2010 15 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 2.31 4.68 -39.23 2 3 1 34 227.25 7
Hi High (pH 8-9.5) 2.31 2.42 -6.06 1 3 0 32 226.242 7

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