UCSF

ZINC28873182

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2009 19 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) 1.86 7.43 -46.53 0 4 -1 62 280.369 3
Hi High (pH 8-9.5) 1.86 7.9 -119.72 0 4 -2 62 279.361 3

Activity (Go SEA)

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