UCSF

ZINC16007480

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2008 17 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) 1.37 2.64 -18.16 1 4 0 51 268.363 1
Ref Reference (pH 7) 1.33 3.37 -19.94 1 4 0 49 268.363 1
Hi High (pH 8-9.5) 1.37 1.98 -45.31 0 4 -1 50 267.355 1

Activity (Go SEA)

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