In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | No |
Popular Name: 3-chloro-1-[4-(3-pyridylmethyl)piperazin-1-yl]propan-1-one 3-chloro-1-[4-(3-pyridylmethyl)p…
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) | 0.59 | 4.52 | -9.14 | 0 | 4 | 0 | 36 | 267.76 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 6.74 | -50.2 | 1 | 4 | 1 | 38 | 268.768 | 4 | ↓ |