In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 14 | Yes |
Popular Name: (2S)-N2,4-dimethyl-N2-[(1R)-1-methylbutyl]pentane-1,2-diamine (2S)-N2,4-dimethyl-N2-[(1R)-1-me…
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) | 2.56 | 4.4 | -41.12 | 3 | 2 | 1 | 31 | 201.378 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 5.46 | -29.14 | 3 | 2 | 1 | 30 | 201.378 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 5.84 | -116.71 | 4 | 2 | 2 | 32 | 202.386 | 7 | ↓ |