UCSF

ZINC36877298

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 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) 1.54 5.15 -113.31 4 4 2 56 233.315 4
Hi High (pH 8-9.5) 1.54 3.04 -9.32 2 4 0 50 231.299 4
Mid Mid (pH 6-8) 1.54 4.47 -44.42 3 4 1 55 232.307 4

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