In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: (2S)-2-amino-N-cyclopropyl-4-methyl-N-(3-pyridylmethyl)pentanamide (2S)-2-amino-N-cyclopropyl-4-met…
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) | 0.71 | 4.76 | -41.4 | 3 | 4 | 1 | 61 | 262.377 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.71 | 4.49 | -7.28 | 2 | 4 | 0 | 59 | 261.369 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.71 | 5.34 | -93 | 4 | 4 | 2 | 62 | 263.385 | 6 | ↓ |