UCSF

ZINC01283544

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 34 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) 5.95 16.03 -17.24 1 6 0 69 495.048 6
Hi High (pH 8-9.5) 6.13 15.96 -45.12 0 6 -1 71 494.04 6

Activity (Go SEA)

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