UCSF

ZINC36631567

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 18 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) 3.67 6.11 -12.36 1 3 0 38 259.354 1
Mid Mid (pH 6-8) 3.67 7.18 -10.31 0 3 0 34 258.346 1

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