In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 19 | Yes |
Popular Name: (2R)-N',N',4-trimethyl-N-(3-phenylpropyl)pentane-1,2-diamine (2R)-N',N',4-trimethyl-N-(3-phen…
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) | 3.74 | 8.53 | -39.9 | 2 | 2 | 1 | 20 | 263.449 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.74 | 9.35 | -31.78 | 2 | 2 | 1 | 16 | 263.449 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.74 | 10.7 | -124.58 | 3 | 2 | 2 | 21 | 264.457 | 9 | ↓ |