UCSF

ZINC58324235

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 22 Yes

Popular Name: (2R)-2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-1-piperazin-1-yl-propan-1-one (2R)-2-[(6-ethylthieno[2,3-d]pyr…

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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) 1.05 6.11 -52.79 3 6 1 75 320.442 4 ↓
Mid Mid (pH 6-8) 1.05 4.85 -9.28 2 6 0 70 319.434 4 ↓

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

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