In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 20 | Yes |
Popular Name: (2R)-1-[(3-chloro-4-fluoro-phenyl)methylamino]-3-morpholino-propan-2-ol (2R)-1-[(3-chloro-4-fluoro-pheny…
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) | 1.50 | 1.9 | -54.13 | 3 | 4 | 1 | 49 | 303.785 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 0.47 | -7.19 | 2 | 4 | 0 | 45 | 302.777 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.50 | 4.21 | -121.96 | 4 | 4 | 2 | 51 | 304.793 | 6 | ↓ |