UCSF

ZINC71552029

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 26 Yes

Popular Name: (3S)-1-[7-acetyl-2-(dimethylamino)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-N-ethyl-pyrrolidine-3 (3S)-1-[7-acetyl-2-(dimethylamin…

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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) 0.77 8.35 -18.84 1 8 0 82 360.462 4 ↓
Mid Mid (pH 6-8) 0.77 8.73 -42.15 2 8 1 83 361.47 4 ↓

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

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