UCSF

ZINC35568263

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 33 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) 1.88 7.5 -83.31 2 8 0 107 473.595 10
Lo Low (pH 4.5-6) 1.88 6.61 -55.95 3 8 1 104 474.603 10

Activity (Go SEA)

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