UCSF

ZINC02379938

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 31 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 5.89 10.62 -10.89 2 6 0 80 521.198 7
Hi High (pH 8-9.5) 6.07 9.82 -50.91 1 6 -1 86 520.19 7

Activity (Go SEA)

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