In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2010 | 22 | Yes |
Popular Name: methyl 3-amino-4-(4-cyclopentylpiperazin-1-yl)benzoate methyl 3-amino-4-(4-cyclopentylp…
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) | 2.91 | 8.65 | -41.61 | 3 | 5 | 1 | 60 | 304.414 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 6.5 | -4.72 | 2 | 5 | 0 | 59 | 303.406 | 4 | ↓ |