In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 17 | Yes |
Popular Name: (2R)-N-(cyclohexylmethyl)-N',N',4-trimethyl-pentane-1,2-diamine (2R)-N-(cyclohexylmethyl)-N',N',…
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) | 3.71 | 7.49 | -37.6 | 2 | 2 | 1 | 20 | 241.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.70 | 8.11 | -30.8 | 2 | 2 | 1 | 16 | 241.443 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 9.59 | -124.22 | 3 | 2 | 2 | 21 | 242.451 | 7 | ↓ |