In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 31 | Yes |
Popular Name: N-cyclopentyl-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide N-cyclopentyl-1-[4-(4-fluorophen…
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) | 4.60 | 12.16 | -12.68 | 1 | 5 | 0 | 48 | 418.516 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.60 | 12.63 | -42.13 | 2 | 5 | 1 | 50 | 419.524 | 4 | ↓ |