In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 18 | Yes |
Popular Name: 1-amino-3-[4-(2-fluorophenyl)piperazin-1-yl]propan-2-ol 1-amino-3-[4-(2-fluorophenyl)pip…
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) | 0.21 | -0.76 | -51.97 | 4 | 4 | 1 | 54 | 254.329 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.21 | -1.33 | -7.01 | 3 | 4 | 0 | 53 | 253.321 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.21 | 1.64 | -109.35 | 5 | 4 | 2 | 56 | 255.337 | 4 | ↓ |