UCSF

ZINC02783833

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 33 No

Popular Name: 4-[[2-[(3aR,6aR)-5-(4-ethylphenyl)-4,6-diketo-3a,6a-dihydropyrrolo[3,4-d]triazol-1-yl]acetyl]amino]b 4-[[2-[(3aR,6aR)-5-(4-ethylpheny…

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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 6.92 -19.68 1 10 0 121 449.467 8 ↓
Ref Reference (pH 7) 2.89 6.92 -17.69 1 10 0 121 449.467 8 ↓
Ref Reference (pH 7) 2.89 7.92 -26.44 1 10 0 121 449.467 8 ↓
Ref Reference (pH 7) 2.89 7.26 -19.2 1 10 0 121 449.467 8 ↓

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