UCSF

ZINC05562994

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2006 29 Yes

Popular Name: 8-(2-cyclohexylethyl)-5-imino-4-(1H-indol-3-ylmethylene)-9-thia-2,6,7-triazabicyclo[4.3.0]nona-1,7-d 8-(2-cyclohexylethyl)-5-imino-4-…

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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) 4.38 9.42 -19.07 2 6 0 86 405.527 4 ↓
Lo Low (pH 4.5-6) 4.38 9.88 -37.47 3 6 1 87 406.535 4 ↓

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