UCSF

ZINC15938953

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2008 24 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) 5.30 8.7 -4.06 2 3 0 45 322.452 4
Mid Mid (pH 6-8) 5.30 9.53 -39.79 3 3 1 49 323.46 4

Activity (Go SEA)

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