In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2009 | 23 | Yes |
Popular Name: 3-(4-methylpiperazin-1-yl)-1-(4-phenylphenyl)propan-1-one 3-(4-methylpiperazin-1-yl)-1-(4-…
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) | 3.45 | 10 | -41.69 | 1 | 3 | 1 | 25 | 309.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 9.87 | -44.87 | 1 | 3 | 1 | 25 | 309.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 7.53 | -8.01 | 0 | 3 | 0 | 24 | 308.425 | 5 | ↓ |