In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2011 | 15 | Yes |
Popular Name: (2S)-1-(5-bromo-2-thienyl)-3-(2-thienyl)propan-2-amine (2S)-1-(5-bromo-2-thienyl)-3-(2-…
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) | 3.52 | 6.76 | -44.1 | 3 | 1 | 1 | 28 | 303.27 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.52 | 6.44 | -4.11 | 2 | 1 | 0 | 26 | 302.262 | 4 | ↓ |