UCSF

ZINC35497379

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 18 No

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) 2.65 7.52 -49.32 2 5 1 76 267.33 4
Hi High (pH 8-9.5) 2.65 6.24 -10.48 1 5 0 71 266.322 4

Activity (Go SEA)

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