UCSF

ZINC69490386

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 23 Yes

Popular Name: 2-methyl-7-[(1-phenyltriazol-4-yl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 2-methyl-7-[(1-phenyltriazol-4-y…

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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) 0.99 8.31 -52.85 1 6 1 61 307.381 3 ↓
Mid Mid (pH 6-8) 0.99 6.04 -16.33 0 6 0 60 306.373 3 ↓

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

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