In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 12 | Yes |
Popular Name: (2R)-1-[ethyl(isopropyl)amino]-3-(methylamino)propan-2-ol (2R)-1-[ethyl(isopropyl)amino]-3…
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) | 0.53 | 1.99 | -94.43 | 4 | 3 | 2 | 41 | 176.304 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.53 | 2.52 | -37.69 | 3 | 3 | 1 | 44 | 175.296 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.53 | 0.54 | -30.8 | 3 | 3 | 1 | 37 | 175.296 | 6 | ↓ |