UCSF

ZINC40181078

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 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) 1.92 8.82 -11.08 0 5 0 51 320.396 5
Mid Mid (pH 6-8) 1.92 9.07 -30.32 1 5 1 52 321.404 5

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