UCSF

ZINC22538640

Substance Information

In ZINC since Heavy atoms Benign functionality
December 17th, 2008 13 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.03 6.47 -33.86 1 3 1 31 186.275 5
Mid Mid (pH 6-8) 2.03 4.26 -3.42 0 3 0 30 185.267 5

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