UCSF

ZINC36358269

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 25 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) 1.43 11.95 -65.83 1 6 -1 90 365.406 6
Hi High (pH 8-9.5) 1.43 10.09 -95.67 0 6 -2 88 364.398 6

Activity (Go SEA)

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