UCSF

ZINC00320175

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 4.02 9.65 -7.62 2 5 0 49 340.447 5
Mid Mid (pH 6-8) 4.02 7.98 -14.02 1 5 0 48 339.439 5

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