UCSF

ZINC40023214

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2010 28 No

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) 4.21 10.16 -60.92 0 5 -1 74 378.448 6
Mid Mid (pH 6-8) 4.21 9.41 -11.59 1 5 0 71 379.456 6

Activity (Go SEA)

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