UCSF

ZINC42479090

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 20 Yes

Popular Name: 2-[(4-chloro-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl-cyclopropyl-amino]ethanol 2-[(4-chloro-5,6-dimethyl-thieno…

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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) 2.34 5.06 -32.29 2 4 1 50 312.846 5 ↓
Hi High (pH 8-9.5) 2.34 3.06 -8.6 1 4 0 49 311.838 5 ↓

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

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