UCSF

ZINC42337932

Substance Information

In ZINC since Heavy atoms Benign functionality
April 27th, 2010 17 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 1.43 5.69 -42.53 2 4 1 57 232.307 5
Mid Mid (pH 6-8) 1.43 3.06 -11.7 1 4 0 56 231.299 5

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