In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 28 | Yes |
Popular Name: 4-(4-benzylpiperazin-1-yl)-2-phenyl-6,7-dihydro-5H-cyclopenta[e]pyrimidine 4-(4-benzylpiperazin-1-yl)-2-phe…
None
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) | 4.52 | 11.42 | -28.14 | 1 | 4 | 1 | 34 | 371.508 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.52 | 13.74 | -85.34 | 2 | 4 | 2 | 35 | 372.516 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.52 | 11.12 | -9.18 | 0 | 4 | 0 | 32 | 370.5 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.52 | 14.41 | -42.51 | 1 | 4 | 1 | 33 | 371.508 | 4 | ↓ |