UCSF

ZINC52917324

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2010 17 Yes

Popular Name: (4S)-5-prop-2-ynyl-4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine (4S)-5-prop-2-ynyl-4-(2-thienyl)…

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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) 3.45 7.62 -4.52 0 1 0 3 259.399 2 ↓
Lo Low (pH 4.5-6) 3.45 9.74 -31.64 1 1 1 4 260.407 2 ↓

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

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