UCSF

ZINC05561768

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2006 28 Yes

Popular Name: N-[3-(4-chlorophenyl)-5-phenyl-2,6,7,9-tetrazabicyclo[4.3.0]nona-7,9-dien-8-yl]-2-methyl-propanamide N-[3-(4-chlorophenyl)-5-phenyl-2…

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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) 4.23 14.55 -15 2 6 0 72 395.894 4 ↓
Hi High (pH 8-9.5) 4.41 14.85 -15.72 2 6 0 75 395.894 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.