UCSF

ZINC27886765

Substance Information

In ZINC since Heavy atoms Benign functionality
February 21st, 2009 21 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) 0.95 3.41 -54.39 4 6 1 87 287.343 6
Hi High (pH 8-9.5) 0.95 2.02 -14.74 3 6 0 83 286.335 6

Activity (Go SEA)

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