UCSF

ZINC49538160

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 19 Yes

Popular Name: 1-(5-chloro-2-thienyl)-2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone 1-(5-chloro-2-thienyl)-2-[(4S)-4…

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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) 4.02 9.76 -38.45 1 2 1 22 312.867 3 ↓
Mid Mid (pH 6-8) 4.02 7.74 -6.3 0 2 0 20 311.859 3 ↓

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

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