UCSF

ZINC39893219

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 24 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) 2.51 5.34 -13.79 1 5 0 55 330.428 7
Mid Mid (pH 6-8) 2.51 7.61 -49.87 2 5 1 56 331.436 7

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