| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(5-chloro-2-thienyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]ethanamine (1S)-1-(5-chloro-2-thienyl)-N-[[…
| 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) | 3.91 | 10.4 | -109.35 | 3 | 2 | 2 | 21 | 310.894 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.91 | 7.42 | -2 | 1 | 2 | 0 | 15 | 308.878 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.91 | 9.4 | -36.53 | 2 | 2 | 1 | 16 | 309.886 | 6 | ↓ |
