UCSF

ZINC35337308

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 29 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) 0.13 12.7 -100.1 4 6 2 69 418.969 10
Hi High (pH 8-9.5) 0.13 10.61 -34.7 3 6 1 68 417.961 10

Activity (Go SEA)

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