In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2010 | 16 | Yes |
Popular Name: N-[[5-(1-piperidylmethyl)-2-thienyl]methyl]ethanamine N-[[5-(1-piperidylmethyl)-2-thie…
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) | 2.72 | 8.38 | -83.91 | 3 | 2 | 2 | 21 | 240.416 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 6.16 | -36.63 | 2 | 2 | 1 | 20 | 239.408 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 4.8 | -1.96 | 1 | 2 | 0 | 15 | 238.4 | 5 | ↓ |