UCSF

ZINC27195624

Substance Information

In ZINC since Heavy atoms Benign functionality
February 14th, 2009 17 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) -1.75 -2.2 -172.55 3 8 -2 148 289.161 7
Mid Mid (pH 6-8) -1.75 -3.34 -94.73 4 8 -1 145 290.169 7

Activity (Go SEA)

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