UCSF

ZINC29027595

Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2009 27 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) 1.51 10.16 -52.2 1 8 1 91 377.465 6
Hi High (pH 8-9.5) 1.51 7.7 -16.63 0 8 0 90 376.457 6

Activity (Go SEA)

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