In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 19 | Yes |
Popular Name: N-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]-3-pyrrolidin-1-yl-propan-1-amine N-[(1S)-1-(3-chloro-4-fluoro-phe…
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) | 3.53 | 8.47 | -36.6 | 2 | 2 | 1 | 16 | 285.814 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 9.75 | -115.1 | 3 | 2 | 2 | 21 | 286.822 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 7.23 | -47.43 | 2 | 2 | 1 | 20 | 285.814 | 6 | ↓ |