UCSF

ZINC35907740

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2009 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) 1.06 9.39 -52.07 1 6 1 62 374.436 3
Hi High (pH 8-9.5) 1.06 6.97 -18.68 0 6 0 61 373.428 3

Activity (Go SEA)

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