UCSF

ZINC35633867

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 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) 2.39 6.21 -48.1 2 4 1 54 329.511 6
Hi High (pH 8-9.5) 2.39 5.09 -7.7 1 4 0 49 328.503 6

Activity (Go SEA)

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