UCSF

ZINC49389726

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 20 Yes

Popular Name: N-[(1S)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine N-[(1S)-1-(1,3,5-trimethylpyrazo…

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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) 2.06 7.07 -11.37 1 5 0 56 287.392 3 ↓
Lo Low (pH 4.5-6) 2.06 7.2 -34.3 2 5 1 57 288.4 3 ↓
Lo Low (pH 4.5-6) 2.06 7.53 -34.13 2 5 1 57 288.4 3 ↓

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

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