UCSF

ZINC21877642

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2008 32 Yes

Popular Name: (6S)-N'-cyclopentyl-6-methyl-4-oxo-5-propyl-N-(3-pyridylmethyl)-7H-pyrazolo[1,5-d]pyrazine-2,6-dicar (6S)-N'-cyclopentyl-6-methyl-4-o…

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Download: MOL2 SDF SMILES Flexibase

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) 1.34 5.71 -14.48 2 9 0 109 438.532 7 ↓
Lo Low (pH 4.5-6) 1.34 6.14 -48.12 3 9 1 110 439.54 7 ↓

Activity (Go SEA)

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