UCSF

ZINC07357425

Substance Information

In ZINC since Heavy atoms Benign functionality
May 26th, 2006 25 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) 4.03 5.71 -12.49 3 7 0 118 363.439 4
Hi High (pH 8-9.5) 4.03 6.43 -42.96 2 7 -1 120 362.431 4

Activity (Go SEA)

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