UCSF

ZINC63952338

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 21 No

Popular Name: 2-[2-[(2S)-2,5-dimethyl-2,3-dihydropyrrol-1-yl]thiazol-4-yl]-N-(1H-1,2,4-triazol-5-yl)acetamide 2-[2-[(2S)-2,5-dimethyl-2,3-dihy…

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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) -2.65 7.63 -48.73 1 7 0 93 304.379 4 ↓
Hi High (pH 8-9.5) 1.74 7.44 -46.78 1 7 -1 93 303.371 4 ↓
Hi High (pH 8-9.5) 1.76 7.27 -49.69 1 7 -1 93 303.371 4 ↓
Lo Low (pH 4.5-6) -2.66 8.33 -34.47 2 7 1 90 305.387 3 ↓

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

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