UCSF

ZINC36870285

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 18 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) 0.19 1.73 -52.73 2 5 1 71 275.394 2
Hi High (pH 8-9.5) 0.19 0.36 -16.58 1 5 0 66 274.386 2

Activity (Go SEA)

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