UCSF

ZINC54697402

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2010 15 No

Popular Name: 3-(2-methyl-5-propyl-1,2,4-triazol-3-yl)thiophen-2-amine 3-(2-methyl-5-propyl-1,2,4-triaz…

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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) 1.02 4.91 -14.26 1 4 0 55 222.317 3 ↓
Mid Mid (pH 6-8) 1.93 4.66 -7.73 2 4 0 57 222.317 3 ↓

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

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