UCSF

ZINC60118528

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2011 43 No

Popular Name: (3S)-3-[[8-(1-benzyl-4-piperidyl)-6-(o-tolyl)-7-oxo-pyrido[2,3-d]pyrimidin-2-yl]amino]-N-isopropyl-p (3S)-3-[[8-(1-benzyl-4-piperidyl…

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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) 5.94 18.16 -48.81 3 9 1 97 580.757 7 ↓
Hi High (pH 8-9.5) 5.94 15.91 -21.28 2 9 0 95 579.749 7 ↓

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

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