UCSF

ZINC09578765

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2007 31 Yes

Popular Name: N-[2-[4-[(4-chlorophenyl)methylamino]-5,6,8,9-tetrazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-yl]ethyl]- N-[2-[4-[(4-chlorophenyl)methyla…

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) 3.74 -5.39 -20.16 2 8 0 101 456.959 8 ↓

Activity (Go SEA)

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