UCSF

ZINC44125411

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2010 12 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) 2.39 3.67 -4.05 2 2 0 29 205.088 2
Mid Mid (pH 6-8) 2.39 3.45 -42.9 3 2 1 31 206.096 2
Lo Low (pH 4.5-6) 2.39 5.23 -35.07 3 2 1 30 206.096 2

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