UCSF

ZINC06902097

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2006 30 Yes

Popular Name: 3-cyclopropyl-7-methyl-9-(p-tolyl)-N-(2-pyridylmethyl)-2,8,9-triazabicyclo[4.3.0]nona-1,3,5,7-tetrae 3-cyclopropyl-7-methyl-9-(p-toly…

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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) 2.89 10.54 -14.37 1 6 0 73 397.482 5 ↓
Lo Low (pH 4.5-6) 2.89 10.81 -47.3 2 6 1 74 398.49 5 ↓

Activity (Go SEA)

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