In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 14 | Yes |
Popular Name: (2S)-N2-cyclopentyl-N2-ethyl-3-methyl-butane-1,2-diamine (2S)-N2-cyclopentyl-N2-ethyl-3-m…
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) | 2.03 | 5.26 | -112.59 | 4 | 2 | 2 | 32 | 200.37 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 3.74 | -39.33 | 3 | 2 | 1 | 31 | 199.362 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 4.41 | -24.59 | 3 | 2 | 1 | 30 | 199.362 | 5 | ↓ |