In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 2-[cyclopentyl(2-hydroxyethyl)amino]-6-methyl-pyridine-3-carboxamidine 2-[cyclopentyl(2-hydroxyethyl)am…
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) | 0.30 | 3.29 | -34.43 | 5 | 5 | 1 | 88 | 263.365 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 3.53 | -6.59 | 4 | 5 | 0 | 86 | 262.357 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.30 | 3.75 | -86.93 | 6 | 5 | 2 | 89 | 264.373 | 5 | ↓ |