In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 14 | Yes |
Popular Name: 1-[(4-methylpiperazin-1-yl)methyl]cyclopentan-1-amine 1-[(4-methylpiperazin-1-yl)methy…
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) | 1.12 | 3.45 | -94.4 | 4 | 3 | 2 | 35 | 199.342 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 2.87 | -120.55 | 4 | 3 | 2 | 35 | 199.342 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 0.98 | -39.77 | 3 | 3 | 1 | 34 | 198.334 | 2 | ↓ |