UCSF

ZINC35295696

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 19 Yes

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) 0.54 1.2 -54.44 3 4 1 71 288.364 4
Mid Mid (pH 6-8) 0.54 0.26 -13 2 4 0 66 287.356 4

Activity (Go SEA)

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