In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2010 | 17 | Yes |
Popular Name: [(2S)-1-[(4-amino-2-thienyl)sulfonyl]-2-piperidyl]methanol [(2S)-1-[(4-amino-2-thienyl)sulf…
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) | 0.87 | 0.05 | -7.86 | 3 | 5 | 0 | 84 | 276.383 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.87 | -0.11 | -49.05 | 4 | 5 | 1 | 85 | 277.391 | 3 | ↓ |