UCSF

ZINC35305378

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 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) -1.65 3.48 -35.41 2 7 0 94 243.263 5
Hi High (pH 8-9.5) -1.65 1.23 -50.3 1 7 -1 93 242.255 5

Activity (Go SEA)

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