In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 13 | Yes |
Popular Name: (3R)-N3-(1-ethylpropyl)-N3-methyl-pentane-1,3-diamine (3R)-N3-(1-ethylpropyl)-N3-methy…
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 | 4.5 | -100.86 | 4 | 2 | 2 | 32 | 188.359 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 4.13 | -28.09 | 3 | 2 | 1 | 30 | 187.351 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 2.56 | -42.07 | 3 | 2 | 1 | 31 | 187.351 | 7 | ↓ |