UCSF

ZINC03911225

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 17th, 2005 25 Yes

Popular Name: N-cycloheptyl-4-(2,2-dioxo-2$l^{6}-thia-3,5-diazabicyclo[4.4.0]deca-4,7,9,11-tetraen-4-yl)-butanamid N-cycloheptyl-4-(2,2-dioxo-2$l^{…

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) 3.38 5.56 -38.48 2 6 0 88 363.483 5 ↓
Hi High (pH 8-9.5) 2.73 -6.12 -48.13 1 6 -1 89 362.475 5 ↓

Activity (Go SEA)

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