UCSF

ZINC34594258

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 22 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) 1.00 4.43 -28.12 3 6 1 65 302.402 4
Lo Low (pH 4.5-6) 1.00 6.7 -92.39 4 6 2 66 303.41 4

Activity (Go SEA)

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