UCSF

ZINC00808849

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 29 No

Popular Name: 3-amino-8-isopropyl-5-(3-pyridyl)-10-(3-pyridylmethylene)-2-oxa-8-azabicyclo[4.4.0]deca-3,11-diene-4 3-amino-8-isopropyl-5-(3-pyridyl…

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Vendors

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) 2.08 7.99 -49.11 3 6 1 89 386.479 3 ↓
Lo Low (pH 4.5-6) 2.08 8.27 -101.99 4 6 2 91 387.487 3 ↓
Lo Low (pH 4.5-6) 2.08 8.27 -106.36 4 6 2 91 387.487 3 ↓
Lo Low (pH 4.5-6) 2.08 8.55 -176.22 5 6 3 92 388.495 3 ↓

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