UCSF

ZINC16283649

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2008 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) 1.08 4.11 -46.9 0 5 -1 55 284.386 3
Mid Mid (pH 6-8) 0.36 4.4 -22.21 1 5 0 58 285.394 3

Activity (Go SEA)

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