UCSF

ZINC35427125

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2009 21 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) 3.46 5.04 -11.08 1 4 0 63 311.288 3
Mid Mid (pH 6-8) 3.99 4.75 -10.96 2 4 0 65 311.288 3

Activity (Go SEA)

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