UCSF

ZINC36156971

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 27 Yes

Popular Name: 2-[[[(2S)-3-allyloxy-2-hydroxy-propyl]-isopropyl-amino]methyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[ 2-[[[(2S)-3-allyloxy-2-hydroxy-p…

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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) 2.49 7.24 -52.24 3 6 1 80 392.545 9 ↓
Hi High (pH 8-9.5) 2.94 4.44 -49.51 2 6 0 83 391.537 9 ↓

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