In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 18 | Yes |
Popular Name: (1S)-1-(5-chloro-2-thienyl)-1-[(2S)-2,3-dihydrobenzofuran-2-yl]-N-methyl-methanamine (1S)-1-(5-chloro-2-thienyl)-1-[(…
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) | 4.04 | 7.58 | -43.82 | 2 | 2 | 1 | 26 | 280.8 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.04 | 6.35 | -5.3 | 1 | 2 | 0 | 21 | 279.792 | 3 | ↓ |