UCSF

ZINC01609604

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 15 Yes

CAS Numbers: 27985-70-2 , 93891-78-2

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) 5.34 0.81 -3.21 1 1 0 20 206.329 6

Activity (Go SEA)

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