UCSF

ZINC36721135

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 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) 2.97 9.61 -51.57 2 5 1 72 295.403 10
Hi High (pH 8-9.5) 2.97 8.4 -7.29 1 5 0 67 294.395 10

Activity (Go SEA)

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