In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1S)-N-cyclopropyl-1-(3,4-difluorophenyl)-N-propyl-ethane-1,2-diamine (1S)-N-cyclopropyl-1-(3,4-difluo…
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) | 2.23 | 6.97 | -137.6 | 4 | 2 | 2 | 32 | 256.34 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 5.1 | -51.67 | 3 | 2 | 1 | 31 | 255.332 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 6.58 | -36.15 | 3 | 2 | 1 | 30 | 255.332 | 6 | ↓ |