In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 17 | Yes |
Popular Name: N-cyclopentyl-N-(2-pyridylmethyl)propane-1,3-diamine N-cyclopentyl-N-(2-pyridylmethyl…
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) | 1.04 | 3.37 | -46.4 | 3 | 3 | 1 | 44 | 234.367 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 4.86 | -33.4 | 3 | 3 | 1 | 43 | 234.367 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 4.09 | -84.68 | 4 | 3 | 2 | 45 | 235.375 | 6 | ↓ |