In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 21 | Yes |
Popular Name: (2S)-N-(4-amino-2-chloro-phenyl)-2-(azocan-1-yl)propanamide (2S)-N-(4-amino-2-chloro-phenyl)…
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) | 3.08 | 6.88 | -34.39 | 4 | 4 | 1 | 60 | 310.849 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.08 | 5.66 | -7.85 | 3 | 4 | 0 | 58 | 309.841 | 3 | ↓ |