UCSF

ZINC22771397

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 29 No

Popular Name: 2-[(3aR,6aR)-5-(3-chloro-4-methyl-phenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d]triazol-3-yl]-N-(m-to 2-[(3aR,6aR)-5-(3-chloro-4-methy…

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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) 2.90 5.54 -12.87 1 8 0 94 411.849 4 ↓
Ref Reference (pH 7) 2.90 6.06 -14.77 1 8 0 94 411.849 4 ↓
Ref Reference (pH 7) 2.90 5.58 -14.81 1 8 0 94 411.849 4 ↓
Ref Reference (pH 7) 2.90 6.7 -20.54 1 8 0 94 411.849 4 ↓

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