UCSF

ZINC67963807

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 27 Yes

Popular Name: (2S)-7-chloro-2-[1-methyl-3-(3-pyridyl)pyrazol-4-yl]-3-propyl-1,2-dihydroquinazolin-4-one (2S)-7-chloro-2-[1-methyl-3-(3-p…

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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) 2.66 8.5 -9.52 1 6 0 63 381.867 4 ↓
Lo Low (pH 4.5-6) 2.66 8.99 -46.48 2 6 1 64 382.875 4 ↓

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

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