UCSF

ZINC32975366

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2009 19 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) 0.10 3.29 -17.15 0 5 0 44 283.397 1
Mid Mid (pH 6-8) 0.10 5.68 -54.78 1 5 1 45 284.405 1

Activity (Go SEA)

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