UCSF

ZINC35162506

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2009 17 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) -1.94 -3.12 -11.13 3 8 0 117 243.219 5
Hi High (pH 8-9.5) -1.76 -5.11 -44.38 2 8 -1 123 242.211 5

Activity (Go SEA)

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