UCSF

ZINC38139352

Substance Information

In ZINC since Heavy atoms Benign functionality
January 4th, 2010 34 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) -5.17 -14.58 -323.89 17 14 4 258 500.59 6
Hi High (pH 8-9.5) -5.17 -16.95 -55.15 14 14 1 250 497.566 6
Hi High (pH 8-9.5) -5.17 -17.86 -8.78 13 14 0 248 496.558 6
Hi High (pH 8-9.5) -5.17 -16.67 -132.11 15 14 2 252 498.574 6
Mid Mid (pH 6-8) -5.17 -15.13 -202.36 16 14 3 256 499.582 6
Mid Mid (pH 6-8) -5.17 -15.48 -172.16 16 14 3 256 499.582 6

Vendor Notes

Note Type Comments Provided By
therap antibacterial MicroSource Spectrum

Activity (Go SEA)

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