UCSF

ZINC37185087

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 16 Yes

Popular Name: N-[(1S)-1,2-bis(2-thienyl)ethyl]prop-2-en-1-amine N-[(1S)-1,2-bis(2-thienyl)ethyl]…

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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) 3.93 8.39 -32.72 2 1 1 17 250.412 6 ↓
Mid Mid (pH 6-8) 3.93 7.18 -2.58 1 1 0 12 249.404 6 ↓

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

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