UCSF

ZINC19453663

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 28 Yes

Popular Name: 5-[(2-isopropyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methyl]-N,N-dimethyl-py 5-[(2-isopropyl-4-pyrrolidin-1-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) 2.26 12.01 -112.24 2 7 2 64 383.544 5 ↓
Hi High (pH 8-9.5) 2.26 9.33 -11.67 0 7 0 61 381.528 5 ↓
Hi High (pH 8-9.5) 2.26 9.68 -30.93 1 7 1 63 382.536 5 ↓
Mid Mid (pH 6-8) 2.26 11.66 -52.38 1 7 1 62 382.536 5 ↓

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

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