UCSF

ZINC63944446

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 28 No

Popular Name: (2S)-3-acetyl-N-[2-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-2,4-dimethyl-2H-pyrrole-5- (2S)-3-acetyl-N-[2-(5-cyclopropy…

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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) 2.19 7.9 -13.98 2 7 0 100 377.448 5 ↓
Hi High (pH 8-9.5) 2.38 6.7 -57.46 1 7 -1 106 376.44 5 ↓

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

No pre-computed analogs available. Try a structural similarity search.