UCSF

ZINC06621892

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 31 No

Popular Name: 2-[4-(4-amino-3-cyano-9-methyl-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,6,9-trien-2-yl)phenoxy]-N-benzyl- 2-[4-(4-amino-3-cyano-9-methyl-5…

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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) 2.00 4.35 -18.69 4 8 0 126 415.453 6 ↓
Mid Mid (pH 6-8) 2.00 4.98 -16.68 4 8 0 126 415.453 6 ↓

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