UCSF

ZINC01876039

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2005 31 No

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) 3.37 1.74 -49.01 2 6 1 71 427.496 8
Mid Mid (pH 6-8) 2.78 1.6 -58.5 1 6 1 68 427.496 8

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