UCSF

ZINC34625720

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 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) 3.54 6.62 -12.56 1 4 0 50 287.29 4
Hi High (pH 8-9.5) 3.54 7.35 -43.36 0 4 -1 53 286.282 4

Activity (Go SEA)

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