UCSF

ZINC44018593

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2010 27 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) 7.85 16.24 -47.16 0 3 -1 45 384.927 9

Activity (Go SEA)

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