UCSF

ZINC20441434

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 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) 2.29 9.21 -41.55 1 4 1 42 289.399 7
Hi High (pH 8-9.5) 2.29 7.2 -6.51 0 4 0 41 288.391 7

Activity (Go SEA)

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