UCSF

ZINC37195508

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 18 Yes

Popular Name: (2S)-N-[(1R)-1,2-bis(2-thienyl)ethyl]pentan-2-amine (2S)-N-[(1R)-1,2-bis(2-thienyl)e…

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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) 5.05 9.94 -28.83 2 1 1 17 280.482 7 ↓
Hi High (pH 8-9.5) 5.05 8.96 -2.19 1 1 0 12 279.474 7 ↓

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

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