UCSF

ZINC67947549

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 25 Yes

Popular Name: N-[2-(4-ethyl-1,2,4-triazol-3-yl)ethyl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine N-[2-(4-ethyl-1,2,4-triazol-3-yl…

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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) 2.79 12.12 -17.48 1 6 0 69 334.427 6 ↓
Mid Mid (pH 6-8) 2.79 12.44 -35.31 2 6 1 70 335.435 6 ↓

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

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