UCSF

ZINC06599341

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2006 16 Yes

CAS Number: 3690-10-6

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) -1.75 -6.6 -22.9 3 7 0 105 228.204 2

Activity (Go SEA)

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