UCSF

ZINC01329826

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 26 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) 2.27 -8.69 -17.82 2 8 0 114 396.494 7
Hi High (pH 8-9.5) 2.27 -8.11 -40.96 1 8 -1 116 395.486 7

Activity (Go SEA)

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