In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: (2S,3S)-N2-methyl-N3-propyl-N2-(3-pyridylmethyl)pentane-2,3-diamine (2S,3S)-N2-methyl-N3-propyl-N2-(…
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) | 2.36 | 5.93 | -35.99 | 2 | 3 | 1 | 33 | 250.41 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 7.05 | -35.38 | 2 | 3 | 1 | 29 | 250.41 | 8 | ↓ |