UCSF

ZINC13239510

Substance Information

In ZINC since Heavy atoms Benign functionality
June 12th, 2008 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.19 4.59 -49.8 1 8 -1 129 375.382 7
Hi High (pH 8-9.5) 2.19 4.66 -116.12 0 8 -2 131 374.374 7

Activity (Go SEA)

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