UCSF

ZINC37029794

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 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) 1.47 3.82 -59.09 4 6 1 103 256.257 5
Hi High (pH 8-9.5) 1.47 3.49 -17.18 3 6 0 101 255.249 5

Activity (Go SEA)

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