UCSF

ZINC35779198

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2009 16 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) 1.84 6.07 -18.03 1 4 0 62 213.24 2
Mid Mid (pH 6-8) 2.30 4.16 -9.7 1 4 0 62 213.24 2

Activity (Go SEA)

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