UCSF

ZINC34682391

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 29 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) 2.17 10.47 -100.06 2 7 2 55 400.523 5
Hi High (pH 8-9.5) 2.17 5.78 -8.74 0 7 0 52 398.507 5
Mid Mid (pH 6-8) 2.17 8.13 -43.97 1 7 1 54 399.515 5

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