UCSF

ZINC37268207

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2009 18 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) 0.08 0.72 -50.26 6 6 1 103 251.31 5
Hi High (pH 8-9.5) 0.08 -1.5 -19.45 5 6 0 101 250.302 5

Activity (Go SEA)

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