UCSF

ZINC11904013

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2008 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) 0.72 -3.95 -49.78 1 6 -1 96 258.275 6
Hi High (pH 8-9.5) 0.72 -3.38 -102.08 0 6 -2 98 257.267 6

Activity (Go SEA)

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