UCSF

ZINC19453631

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 29 Yes

Popular Name: N-[4-[(2-isopropyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methyl]phenyl]acetam N-[4-[(2-isopropyl-4-pyrrolidin-…

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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) 2.63 10.6 -116.33 3 6 2 64 395.551 5 ↓
Hi High (pH 8-9.5) 2.63 7.92 -14.51 1 6 0 61 393.535 5 ↓
Hi High (pH 8-9.5) 2.63 8.27 -37.15 2 6 1 63 394.543 5 ↓
Mid Mid (pH 6-8) 2.63 10.25 -52.21 2 6 1 63 394.543 5 ↓

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

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