In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 27 | Yes |
Popular Name: 4-chloro-N-[3-[[(2S)-2-dimethylamino-2-(3-fluorophenyl)ethyl]amino]-3-oxo-propyl]benzamide 4-chloro-N-[3-[[(2S)-2-dimethyla…
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) | 2.94 | 8.44 | -69.35 | 3 | 5 | 1 | 63 | 392.882 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 5.95 | -22.17 | 2 | 5 | 0 | 61 | 391.874 | 8 | ↓ |