In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2009 | 24 | Yes |
Popular Name: 3-chloro-N-[(2S)-2-(4-methylpiperazin-1-yl)-2-(2-thienyl)ethyl]benzamide 3-chloro-N-[(2S)-2-(4-methylpipe…
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) | 3.19 | 7.46 | -45.69 | 2 | 4 | 1 | 37 | 364.922 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.19 | 5.08 | -9.43 | 1 | 4 | 0 | 36 | 363.914 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.19 | 7.43 | -42.14 | 2 | 4 | 1 | 37 | 364.922 | 5 | ↓ |