UCSF

ZINC04127265

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2005 15 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) -1.51 -0.29 -23.55 0 7 0 79 210.193 1

Activity (Go SEA)

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