UCSF

ZINC32196458

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 25 Yes

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) 9.12 18.23 -43.29 0 2 -1 40 351.595 21
Lo Low (pH 4.5-6) 9.12 16.26 -5.06 1 2 0 37 352.603 21

Vendor Notes

Note Type Comments Provided By
MP 76 TCI
Purity 95% Fluorochem
Purity 95+% Fluorochem

Activity (Go SEA)

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