UCSF

ZINC15894456

Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2008 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) 1.03 4.72 -22.99 0 7 0 85 410.517 4
Lo Low (pH 4.5-6) 1.03 5.67 -49.82 1 7 1 87 411.525 4

Activity (Go SEA)

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