In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2011 | 23 | Yes |
Popular Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-cyano-1-piperidyl)propanamide N-(3-cyano-5,6-dihydro-4H-cyclop…
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) | 2.10 | 6.91 | -11.96 | 1 | 5 | 0 | 80 | 328.441 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 9.14 | -59.14 | 2 | 5 | 1 | 81 | 329.449 | 4 | ↓ |