UCSF

ZINC05562085

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2006 31 Yes

Popular Name: N-[3,5-bis(4-methoxyphenyl)-2,6,7,9-tetrazabicyclo[4.3.0]nona-7,9-dien-8-yl]butanamide N-[3,5-bis(4-methoxyphenyl)-2,6,…

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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) 3.98 12.71 -18.01 2 8 0 90 421.501 7 ↓
Hi High (pH 8-9.5) 4.16 13.01 -18.94 2 8 0 93 421.501 7 ↓

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Rings

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