In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 37 | Yes |
Popular Name: N-(3,4-dimethoxyphenyl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]isoquinoline-7-carboxamide N-(3,4-dimethoxyphenyl)-1-[4-(4-…
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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) | 4.43 | 11.32 | -17.16 | 1 | 8 | 0 | 76 | 498.583 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 11.79 | -47.1 | 2 | 8 | 1 | 77 | 499.591 | 7 | ↓ |