UCSF

ZINC00237568

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 21 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) 3.50 -2.5 -44.5 2 3 1 27 303.813 3

Activity (Go SEA)

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