UCSF

ZINC06914161

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 2nd, 2006 27 Yes

Popular Name: N-benzyl-4-(7,7-dioxo-7$l^{6}-thia-8,10-diazabicyclo[4.4.0]deca-2,4,9,11-tetraen-9-yl)-N-ethyl-butan N-benzyl-4-(7,7-dioxo-7$l^{6}-th…

Find On: PubMed — Wikipedia — Google

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) 2.34 -4.03 -20.73 1 6 0 78 385.489 7 ↓
Hi High (pH 8-9.5) 2.34 -3.45 -49.5 0 6 -1 80 384.481 7 ↓

Activity (Go SEA)

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