UCSF

ZINC00265386

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 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) 1.91 5.64 -7.08 1 4 0 55 269.347 4
Hi High (pH 8-9.5) 1.97 4.01 -44.22 0 4 -1 62 268.339 4

Activity (Go SEA)

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