UCSF

ZINC03979001

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2005 27 No

CAS Number: 571-67-5

Download: MOL2 SDF SMILES Flexibase

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) 2.08 2.14 -15.65 3 9 0 147 372.285 1
Hi High (pH 8-9.5) 2.08 3.92 -92.25 1 9 -2 153 370.269 1
Mid Mid (pH 6-8) 2.08 3.15 -46.4 2 9 -1 150 371.277 1
Mid Mid (pH 6-8) 2.08 2.91 -48.94 2 9 -1 150 371.277 1

Vendor Notes

Note Type Comments Provided By
therap antibacterial MicroSource Spectrum

Activity (Go SEA)

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