UCSF

ZINC35305507

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 17 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) -1.17 5.1 -46.31 1 7 0 92 254.271 4
Hi High (pH 8-9.5) -1.17 2.81 -56.7 0 7 -1 91 253.263 4

Activity (Go SEA)

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