UCSF

ZINC11817344

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2008 27 Yes

Popular Name: 2-chloro-N-[(1S)-1-[5-methyl-1-(2-pyridyl)pyrazol-4-yl]ethyl]-6,7-dihydro-5H-cyclopenta[e]pyridine-3 2-chloro-N-[(1S)-1-[5-methyl-1-(…

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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) 3.09 -0.38 -16.81 1 6 0 73 381.867 4 ↓
Lo Low (pH 4.5-6) 3.09 -0.31 -44.15 2 6 1 74 382.875 4 ↓

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