UCSF

ZINC06501724

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2006 24 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) 1.91 8.12 -29.68 1 8 0 121 326.312 3
Hi High (pH 8-9.5) 2.43 7.27 -45.5 0 8 -1 127 325.304 3

Activity (Go SEA)

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