UCSF

ZINC32508187

Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2009 32 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) 4.67 8.92 -18.49 0 6 0 76 472.632 7
Lo Low (pH 4.5-6) 4.67 9.97 -44.99 1 6 1 78 473.64 7

Activity (Go SEA)

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