UCSF

ZINC04348680

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2005 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 4.10 10.14 -12.02 1 9 0 134 372.362 5
Hi High (pH 8-9.5) 4.17 8.5 -38.08 0 9 -1 140 371.354 5

Activity (Go SEA)

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